COMPOUND GROUP NAME | POPULATION STATUS | DATE POPULATED | DESCRIPTION | PROFILE TYPE | # MEMBERS | # HAZARDS |
---|---|---|---|---|---|---|
C1-C4 Halogenated Hydrocarbons (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 343 | 3 | |
Diisocyanates (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 24 | 6 | |
Dioctyltin dilaurate, stannane, dioctyl-, bis(coco acyloxy) derivs., and any other stannane, dioctyl-, bis(fatty acyloxy) derivs. wherein C12 is the predominant carbon number of the fatty acyloxy moiety | This compound group has not been populated yet. |
0 | 1 | |||
Dioxin and Dioxin-like Compounds (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 17 | 17 | |
ETHYLENEBISDITHIOCARBAMIC ACID, SALTS AND ESTERS | 7 | 1 | ||||
Fatty acid dialkylamides and dialkanolamides | 2 | 0 | ||||
Hexabromocyclodecane (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 4 | 2 | |
methylphenylenediamines, their n- substituted derivatives and their salts | 6 | 1 | ||||
Monoalkylamines, monoalkanolamines and their salts | 18 | 0 | ||||
n-substituted derivatives of p-phenylenediamine and their salts | 4 | 0 | ||||
Nitrate compounds (water dissociable) | 0 | 1 | ||||
Non hexavalent chromium compounds excluding Chromium III oxides | 0 | 1 | ||||
Nonphenol Ethoxylates (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 205 | 31 | |
Nonphenols (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 9 | 27 | |
Organophosphate Ester Flame Retardants (OPE FR) | This compound group is populated from combined lists of organophosphorous flame retardants and only includes those that are organophosphate esters. This list is affiliated with Cradle to Cradle Certified® and Green Science Policy Institute. |
132 | 1 | |||
Polychlorophenols and their sodium salts | 04/13/20 | 9 | 2 | |||
Polycyclic Aromatic Compounds (TRI Category) | 03/09/21 | This compound group was populated using a list of chemicals that are reportable under the MA Toxics Use Reduction Act (TURA). See https://www.mass.gov/guides/massdep-toxics-use-reduction-program#-listed-chemicals- for more information. |
fixed list | 31 | 4 | |
Silver Compounds | 1 | 1 | ||||
sunscreens | 9 | 0 | ||||
Thioglycolic acid and its salts | CASRN taken from https://ntp.niehs.nih.gov/ntp/htdocs/chem_background/exsumpdf/sodiumthioglycolate_508.pdf |
4 | 1 | |||
thioglycolic acid esters | CASRN taken from https://ntp.niehs.nih.gov/ntp/htdocs/chem_background/exsumpdf/sodiumthioglycolate_508.pdf |
1 | 0 | |||
trialkylamines, trialkanolamines and their salts | 6 | 0 | ||||
Vanadium Compounds | 8 | 1 | ||||
water soluble zinc salts | 7 | 0 | ||||
1-Heptanesulfonamide, decafluorinated compounds (CA SCP list) | complete | This compound group is populated from the CA Safer Consumer Products list at https://dtsc.ca.gov/scp/. |
fixed list | 10 | 14 | |
2,4,5-TRIMETHYLANILINE STRONG ACID SALTS | complete | The only strong acid salt found was the HCl salt. |
other | 2 | 1 | |
ACRYLATES | complete | 08/14/19 | This compound group is defined by the SMILES/SMARTS string 'OC(=O)[CD2]=[CD1]' and limited to compounds with a molecular weight < 200 Da. The molecular weight cutoff is arbitrary, but is intended to capture the bulk of the compounds with potential to be used commercially / as monomers without including an overwhelming number of compounds. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 434 | 3 |
Aflatoxins | complete | 03/08/18 | Group members were obtained from IARC VOL.: 82 (2002) (p. 171) |
6 | 3 | |
Alkylphenols and related compounds | complete | 07/28/17 | This group is populated by more specific groups of alkylphenols and alkylphenol ethoxylates. |
other | 568 | 3 |
Antimony Compounds | complete | 06/06/18 | This compound group is defined by the SMILES string '[Sb]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 966 | 19 |
Antimony Compounds, Organic | complete | 06/06/18 | This compound group is defined by the SMILES string 'C[Sb]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 239 | 19 |
ARISTOLOCHIC ACIDS | complete | 07/09/19 | Aristolochic Acid I and II are the most common. |
fixed list | 3 | 4 |
Arsenic Acid Salts | complete | 08/15/16 | This compound group is defined by the SMILES string 'O[As](=O)(O)O'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 150 | 42 |
ARSENIC COMPOUNDS, ORGANIC | complete | 08/15/16 | This compound group is defined by the SMILES string 'C[As]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | structure | 1630 | 33 |
ARSENIC, INORGANIC OXIDES | complete | 08/09/18 | This compound group has not yet been assigned a structural definition. | other | 8 | 43 |
Asbestos Fibers | complete | 06/04/18 | This compound group has not yet been assigned a structural definition. |
other | 12 | 11 |
Azocolourants and Azodyes | complete | 10/16/20 | This compound group is populated from multiple sources, including the AZODYES chemical list at https://comptox.epa.gov/dashboard/chemical_lists/AZODYES. |
functional use | 323 | 1 |
Barium compounds, soluble | complete | 03/09/20 | This compound group is populated from a list of soluble Barium compounds in https://www.atsdr.cdc.gov/toxprofiles/tp24-c4.pdf. |
other | 11 | 6 |
Barium Salts | complete | 08/03/18 | This compound group is defined by the SMILES string '[BaD0]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
573 | 1 | |
Bisphenol A (BPA)-based chemicals and polymers | complete | This compound group is a curated selection of compounds in the Pharos database whose names include Bisphenol A. |
159 | 0 | ||
Cerium Compounds | complete | 07/31/18 | This compound group is defined by the SMILES string '[Ce]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 349 | 1 |
Chlorinated Organic Solvents in Google's MRSL | complete | 02/12/21 | This compound group was populated from the Google Manufacturing Restricted Substances Specification (v1.0) (TTD_3549) |
fixed list | 20 | 1 |
chloroanilines with the exception of those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | complete | This compound group is composed of the 5 isomers not explicitly included in Annex VI of Regulation (EC) No 1272/2008 (CLP Regulation). Total number of isomers: monochloroanilines (3 isomers), dichloroanilines (6 isomers), trichloroanilines (6 isomers), tetrachloroanilines (3 isomers) and pentachloroaniline (1 isomer).
The following isomers are not included, because they are listed in the Annex as of 7/9/19:
|
fixed list | 5 | 6 | |
Chlorotoluenes | complete | 05/01/17 | This compound group has not yet been assigned a structural definition. |
other | 15 | 4 |
CHROMIUM (III) COMPOUNDS | complete | 11/17/17 | This compound group is defined by the SMILES string '[Cr+3]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 376 | 5 |
CHROMIUM (VI) COMPOUNDS | complete | 11/17/17 | This compound group is defined by the SMILES string '[Cr+6]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | other | 152 | 39 |
cobalt compounds that release cobalt ions in vivo | complete | 10/31/17 | This compound group has not yet been assigned a structural definition. |
fixed list | 15 | 1 |
Cresol isomers | complete | This compound group has not yet been assigned a structural definition. | other | 4 | 1 | |
Crude and refined coal tars | complete | 04/01/21 | This compound group was populated from existing compound groups for the Cradle to Cradle (C2C) RSL. |
48 | 1 | |
CYANIDE COMPOUNDS | complete | This compound group includes both commercially relevant compounds such as Hydrogen Cyanide, Sodium Cyanide, Potassium Cyanide, and Calcium Cyanide, as well as cyanide salts that are less common. |
structure | 39 | 8 | |
Cyclocyloxanes - Biomonitoring CA | complete | This group is populated from the list at https://biomonitoring.ca.gov/chemicals |
fixed list | 3 | 1 | |
Di- and triether of alkanediols and -triols (C3-C8, linear and branched) with epichlorohydrin (content of free epichlorohydrin < 20 ppm, not characterized as H351 or H350) | complete | 06/17/19 | fixed list | 16 | 1 | |
Di-isodecyl phthalate and metabolite | complete | This compound group has not yet been assigned a structural definition. | other | 7 | 0 | |
Di-n-Octyl Phthalate and metabolites | complete | This compound group has not yet been assigned a structural definition. | other | 2 | 0 | |
Dibutyl phthalate and metabolites | complete | This compound group has not yet been assigned a structural definition. | other | 2 | 0 | |
Dichlorobenzenes | complete | This compound group has not yet been assigned a structural definition. | other | 5 | 5 | |
Dichloroethylenes | complete | This compound group has not yet been assigned a structural definition. | other | 6 | 1 | |
dichloropropanes | complete | This compound group has not yet been assigned a structural definition. | other | 17 | 0 | |
Dicyclohexyl phthalate and metabolite | complete | This compound group has not yet been assigned a structural definition. | other | 3 | 0 | |
Diethyl hexyl phthalate and metabolites | complete | This compound group has not yet been assigned a structural definition. | other | 12 | 0 | |
Dimethylarsenic acids | complete | This compound group is defined by the SMILES string '[CH3][As](=O)([CH3])O'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
128 | 36 | ||
Dimethyltin derivatives | complete | 07/26/18 | This compound group is defined by the SMILES string '[CH3][Sn]([CH3])', then subtracting compounds with 3+ methyl ligands. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 276 | 14 |
Diphenyltin derivatives | complete | 07/26/18 | This compound group is defined by the SMILES string '[CH]1=[CH][CH]=C([CH]=[CH]1)[Sn](C2=[CH][CH]=[CH][CH]=[CH]2)'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 153 | 16 |
Endosulfan Isomers | complete | This compound group was populated from the Stockholm POPs Convention decision http://chm.pops.int/TheConvention/ThePOPs/TheNewPOPs/tabid/2511/Default.aspx | fixed list | 2 | 4 | |
Fatty alcohols, saturated, with even-numbered C-chain, number of C-atoms >=16, with terminating OH-group | complete | 39 | 1 | |||
Formaldehyde compounds and polymers | complete | 09/11/18 | This compound group was populated by searching ChemIDplus for all compounds whose name contained "formaldehyde". Additionally, it contains the compounds in its subgroups. |
other | 1161 | 2 |
Formaldehyde Donors | complete | 05/29/20 | This compound group is populated from a list of chemicals in an ECHA Investigation Report - Formaldehyde and Formaldehyde Releasers as well as manual searches. Report downloaded from https://echa.europa.eu/documents/10162/13641/annex_xv_report_formaldehyde_en.pdf/58be2f0a-7ca7-264d-a594-da5051a1c74b 149-44-0 (Sodium formaldehyde sulfoxylate) was added based on suggestion by GreenSeal, citing https://pubchem.ncbi.nlm.nih.gov/compound/Sodium-hydroxymethanesulfinate and https://www.fishersci.com/store/msds?partNumber=AC149190250&productDescription=SODIUM+FORMALDEHYDESULFO+25KG&vendorId=VN00032119&countryCode=US&language=en |
functional use | 187 | 0 |
Germanium Compounds | complete | 08/09/18 | This compound group is defined by the SMILES string '[Ge]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 1206 | 1 |
Gold salts | complete | 04/01/21 | This compound group was populated using a substructure search of PubChem using the SMILES string [Au]. |
element | 495 | 1 |
Halogenated Solvents | complete | 05/17/17 | Includes chemicals from https://www.portlandoregon.gov/water/article/28482 1-Chlorobutane (CAS 109-69-3) added by suggestion of GreenSeal citing https://pubchem.ncbi.nlm.nih.gov/compound/1-Chlorobutane#section=Use-Classification |
functional use | 87 | 4 |
HBCDD ISOMERS (REACH LIST) | complete | This compound group is defined by a list in the Annex XIV of REACH ("Authorisation List") available at https://echa.europa.eu/web/guest/addressing-chemicals-of-concern/authorisation/recommendation-for-inclusion-in-the-authorisation-list/authorisation-list | fixed list | 8 | 5 | |
Hydrofluorocarbons (HFCs) in Google's MRSL | complete | 02/12/21 | This compound group was populated from the Google Manufacturing Restricted Substances Specification (v1.0) (TTD_3549)
|
fixed list | 19 | 1 |
Inorganic Ammonium Salts | complete | 08/01/18 | This compound group is defined by the SMILES string '[NH4] subtracting [NH4].C'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
other | 265 | 2 |
Inorganic cyanide compounds | complete | 03/12/20 | This compound group was manually populated with inorganic cyanide compounds. It is based on an entry in Korea's GHS. |
other | 22 | 13 |
Ioxynil salts | complete | 07/30/18 | This compound group has not yet been assigned a structural definition. |
other | 11 | 0 |
Iron Oxides (MAK list of 4) | complete | This compound group is populated from the MAK list. |
fixed list | 5 | 1 | |
ISOCYANATES | complete | 07/19/17 | This compound group is defined by the SMARTS string "[NX2:2]=[C:1]=[OX1:3]". For more information on SMARTS, see https://en.wikipedia.org/wiki/Smiles_arbitrary_target_specification. |
structure | 2936 | 2 |
Manganese Compounds | complete | 08/09/18 | This compound group is defined by the SMILES string '[Mn]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 614 | 4 |
Molybdenum Compounds | complete | 08/09/18 | This compound group is defined by the SMILES string '[Mo]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 390 | 4 |
Monohalomethanes | complete | This compound group is composed of four chemicals so no substructure search is needed to populate it |
other | 4 | 2 | |
Monomethyltin derivatives | complete | 07/26/18 | This compound group is defined by the SMILES string '[Sn][CH3]' subtracting compounds with 2+ methyl ligands. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 95 | 14 |
Monophenyltin derivatives | complete | 07/26/18 | This compound group is defined by the SMILES string '[CH]1=[CH][CH]=C([CH]=[CH]1)[Sn]', then subtracting compounds matching diphenyltin. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 70 | 16 |
National Health and Nutrition Examination Survey (NHANES) Chemical List | complete | 07/27/20 | This list was copied from https://comptox.epa.gov/dashboard/chemical_lists/NHANES2019 |
fixed list | 494 | 0 |
Nickel Compounds, Soluble (MAK list) | complete | This compound group has been populated using subgroups listed by MAK Commission of Germany. |
fixed list | 11 | 26 | |
ORGANOPHOSPHOROUS COMPOUNDS | complete | 09/13/18 | This compound group is defined by the SMILES string 'POC'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 3174 | 1 |
Ozone Depleting Chemicals (ODCs) in Google's MRSL | complete | 02/12/21 | This compound group was populated from the Google Manufacturing Restricted Substances Specification (v1.0) (TTD_3549) |
fixed list | 209 | 2 |
Pentanol isomers (MAK list) | complete | This compound group has not yet been assigned a structural definition. |
fixed list | 9 | 4 | |
Perfluorocarbons (PFCs) in Google's MRSL | complete | 02/12/21 | This compound group was populated from the Google Manufacturing Restricted Substances Specification (v1.0) (TTD_3549) |
fixed list | 9 | 1 |
Perfluorooctane Sulfonates (PFOS) and PFOS salts in Google's MRSL | complete | 02/12/21 | This compound group was populated from the Google Manufacturing Restricted Substances Specification (v1.0) (TTD_3549) |
fixed list | 29 | 2 |
PHTHALATES (orthophthalates) | complete | This compound group is defined by a substructure search of PubChem using the SMILES string 'COC(=O)c1[cH][cH][cH][cH]c1C(=O)OC'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 712 | 11 | |
POLYBROMINATED BIPHENYLS (PBBs) | complete | This compound group was populated from the 2016 GADSL list at http://www.gadsl.org/ |
other | 56 | 37 | |
POLYCYCLIC AROMATIC COMPOUNDS (OSHA EXCLUSIONS) | complete | This compound group is defined by a list in the US EPA's Toxics Release Inventory (TRI) Basis of OSHA Carcinogens document, available at https://www.epa.gov/toxics-release-inventory-tri-program/tri-basis-osha-carcinogens. | fixed list | 24 | 4 | |
POLYCYCLIC AROMATIC HYDROCARBONS (PAH) | complete | This list is drawn from:
|
other | 97 | 15 | |
Polyhalogenated alicycles (NAS OFR subclass) | complete | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
20 | 11 | ||
Polyhalogenated aliphatic carboxylate (NAS OFR subclass) | complete | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
6 | 11 | ||
Polyhalogenated aliphatic chains (NAS OFR subclass) | complete | 05/21/19 | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
fixed list | 42 | 11 |
Polyhalogenated benzene alicycles (NAS OFR subclass) | complete | 05/21/19 | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
fixed list | 4 | 11 |
Polyhalogenated benzene aliphatics and functionalized (NAS OFR subclass) | complete | 05/21/19 | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
fixed list | 22 | 11 |
Polyhalogenated benzenes (NAS OFR subclass) | complete | 05/21/19 | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
fixed list | 20 | 11 |
Polyhalogenated bisphenol aliphatics and functionalized (NAS OFR subclass) | complete | 05/21/19 | This compound group is populated from a National Academies of Science report "A Class Approach to Hazard Assessment of Organohalogen Flame Retardants (2019)" available at https://www.nap.edu/catalog/25412/a-class-approach-to-hazard-assessment-of-organohalogen-flame-retardants |
fixed list | 42 | 11 |