COMPOUND GROUP NAME | POPULATION STATUS | DATE POPULATED | DESCRIPTION | PROFILE TYPE | # MEMBERS | # HAZARDS |
---|---|---|---|---|---|---|
Crimidine, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 1 | |
Cresol isomers | complete | This compound group has not yet been assigned a structural definition. | other | 4 | 1 | |
Creosote oil and creosote oil acenaphthene fractions and distillates | incomplete | This compound group has not yet been assigned a structural definition. | other | 5 | 1 | |
CREOSOTE COMPOUNDS | incomplete | This compound group has not yet been assigned a structural definition. | other | 10 | 3 | |
Copper compounds | incomplete | This compound group is populated with copper metal, and a limited number of copper salts and alloys. |
element | 7 | 3 | |
Conjugated estrogens | incomplete | This group has not been assigned a structural definition yet. |
0 | 2 | ||
Compounds Potentially Degrading to PFOS | incomplete | List extracted from Annex 1 of Dossier prepared in support for a nomination of PFOS to the UN-ECE LRTAP Protocol and the Stockholm Convention The dossier is prepared by the Swedish Chemicals Inspectorate (KemI) and the Swedish EPA, Sweden August 2004 |
fixed list | 94 | 6 | |
Cobalt-Tungsten Carbide Powders and Hard Metals | incomplete | This compound group has not yet been assigned a structural definition. |
0 | 1 | ||
Cobalt sulfate heptahydrate (and other soluble cobalt(II) salts) | incomplete | This compound group has not yet been assigned a structural definition. | other | 2 | 1 | |
Cobalt nickel compounds | incomplete | This compound group has not yet been assigned a structural definition. | structure | 4 | 1 | |
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 |
COBALT COMPOUNDS | in progress | This compound group is defined by the SMILES string '[Co]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 486 | 20 | |
Coal tars, coal tar pitches, coal tar oils | incomplete | This compound group has not yet been assigned a structural definition. |
other | 12 | 3 | |
Coal tar pitch volatiles (coal tar products) | incomplete | This group has not been assigned a structural definition yet. |
0 | 1 | ||
Coal tar distillates | incomplete | This compound group has not yet been assigned a structural definition. | other | 25 | 1 | |
Coal liquids, liquid solvent extraction and solution | incomplete | This compound group has not yet been assigned a structural definition. | other | 3 | 1 | |
Coal distillates | incomplete | This compound group has not yet been assigned a structural definition. | other | 6 | 1 | |
Clarified oils (petroleum), Heavy Fuel oils | incomplete | This compound group has not yet been assigned a structural definition. | other | 2 | 1 | |
Chromium Compounds | incomplete | This compound group is defined by the SMILES string '[Cr]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
element | 462 | 0 | |
Chromium (VI) compounds, with the exception of barium chromate and of compounds specified elsewhere in Annex VI to Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
68 | 40 | ||
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 | 94 | 35 |
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 | 367 | 3 |
Chromic acid, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 4 | |
Chlorotoluenes | complete | 05/01/17 | This compound group has not yet been assigned a structural definition. |
other | 15 | 3 |
Chloroplatinates | incomplete | This compound group has not yet been assigned a structural definition. |
structure | 5 | 1 | |
CHLOROPHENOLS | incomplete | This compound group has not yet been assigned a structural definition. | other | 4 | 3 | |
chloronitroanilines with the exception of those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
0 | 6 | ||
chloronitroanilines | incomplete | This compound group has not yet been assigned a structural definition. |
structure | 1 | 0 | |
CHLOROFLUOROCARBONS (CFC) | incomplete | This compound group has not yet been assigned a structural definition. A structural search would require eliminating compounds containing carbon-hydrogen bonds, which is challenging. |
other | 25 | 3 | |
Chloroethanes | incomplete | This compound group has not yet been assigned a structural definition. | other | 2 | 2 | |
Chlorobiphenyls that have the molecular formula C12H(10-n)Cln in which "n" is greater than 2 | incomplete | This group is populated by taking the POLYCHLORINATED BIPHENYLS (PCBs) group and removing members with 2 chlorine atoms. |
217 | 30 | ||
Chlorobenzenes (1-6 Chlorines) | incomplete | This compound group has not yet been assigned a structural definition. |
other | 20 | 5 | |
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 | |
Chloroalkyl ethers | incomplete | This compound group has not yet been assigned a structural definition. | other | 4 | 1 | |
CHLORINATED POLYMERS | incomplete | This compound group has not yet been assigned a structural definition. | other | 15 | 1 | |
CHLORINATED PARAFFINS | incomplete | This compound group has not yet been assigned a structural definition. | other | 23 | 4 | |
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 | 21 | 1 |
Chlorinated Organic Compounds | incomplete | This compound group is defined by the SMILES string 'C[Cl]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | structure | 3583 | 0 | |
CHLORINATED FLAME RETARDANTS (CFRs) | incomplete | This compound group has not yet been assigned a structural definition. |
functional use | 36 | 7 | |
Chlorinated biphenyl oxides | incomplete | This compound group has not yet been assigned a structural definition. | other | 1 | 1 | |
Chlorinated Alkanes (C10-20, Environment Canada) aka Chlorinated Paraffins | incomplete | This compound group is chlorinated alkanes that have the molecular formula CnHxCl(2n+2–x) in which 10 ≤ n ≤ 20 (definition used by Environment Canada). |
other | 9 | 5 | |
Chloric acid, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 3 | |
Chlordimeform, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 4 | |
Certain Phthalates (OSPAR) | incomplete | DBP and DEHP were added to the OSPAR List of Chemicals for Priority Action in 1998 as part of the group “certain phthalates”. https://www.ospar.org/documents?v=7028 |
fixed list | 4 | 12 | |
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 |
cellulases with the exception of those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
0 | 0 | ||
CCRIS 33 and 28 | incomplete | This compound group has not yet been assigned a structural definition. | other | 1 | 2 | |
Cartap, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 4 | |
Carboxylic acids (higher fatty acids) barium salts | incomplete | This compound group has not yet been assigned a structural definition. | other | 1 | 1 | |
cadmium compounds, with the exception of cadmium sulphoselenide, reaction of cadmium sulphide with zinc sulphide, reaction of cadmium sulphide with mercury sulphide, and those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals listed. |
340 | 41 | ||
Cadmium Compounds, Soluble | incomplete | This compound group is populated from Table 1-1 of NTP Report on Carcinogens 1997 Background Document for Cadmium at https://ntp.niehs.nih.gov/ntp/newhomeroc/other_background/cadmium_508.pdf. |
other | 5 | 37 | |
Cadmium compounds, inorganic | in progress | This compound group is defined by the SMILES string '[Cd]' and subsequently filtered to remove substances containing '[C]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | other | 163 | 39 | |
CADMIUM COMPOUNDS | in progress | This compound group is defined by the SMILES string '[Cd]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 464 | 36 | |
Butyltin compounds | in progress | This compound group is populated by its subgroups. |
structure | 165 | 8 | |
Butylbenzyl phthalate and metabolite | incomplete | This compound group has not yet been assigned a structural definition. | other | 1 | 1 | |
Butyl phenols | incomplete | Populated from Swedish EPA http://webapps.kemi.se/flodesanalyser/ |
other | 58 | 1 | |
Bromoxynil salts | incomplete | This compound group is defined by the SMILES string 'C1=C(C=C(C(=C1Br)O)Br)C#N'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 1 | 2 | |
Bromofluorocarbons | incomplete | This compound group has not yet been assigned a structural definition. |
other | 4 | 1 | |
Brominated Organic Compounds | incomplete | This compound group is defined by the SMILES string 'C[Br]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | structure | 875 | 0 | |
BROMINATED FLAME RETARDANTS (BFR) | incomplete | This compound group has not yet been assigned a structural definition. | functional use | 176 | 9 | |
Brominated and chlorinated organic compounds used as flame retardants - Biomonitoring CA | incomplete | This group is populated from the list at https://biomonitoring.ca.gov/chemicals |
functional use | 0 | 0 | |
BORON COMPOUNDS | incomplete | This compound group is defined by the SMILES string '[B]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 235 | 3 | |
Blasticidin-S, salts | incomplete | This compound group has not yet been assigned a structural definition. |
other | 0 | 1 | |
Bitumens (MAK list) | incomplete | This groups is populated from chemicals in the MAK list. |
other | 5 | 6 | |
Bitumens | in progress | This compound group is defined based on IARC Monograph 103 at https://monographs.iarc.fr/wp-content/uploads/2018/06/mono103.pdf. "This monograph concerns only bitumens produced by petroleum refining and not naturally ocurring bitumens. Thus the term "bitumens", as used in this volume, refers to the products derived from residues resulting from vacuum distillation of selected petroleum crude oils." |
11 | 4 | ||
Bisphenols in GSPI's 6 Classes | in progress | The list of chemicals in this compound group was provided by Green Science Policy Institute staff as part of their Six Classes program, https://www.sixclasses.org/. |
18 | 2 | ||
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. |
148 | 0 | ||
Bisphenol A (BPA) Structural Analogues | incomplete | This compound group was populated in part from chemicals in the NTP Research Report on Biological Activity of Bisphenol A (BPA) Structural Analogues and Functional Alternatives: Research Report 4, National Toxicology Program, October 2017. https://ntp.niehs.nih.gov/ntp/results/pubs/rr/reports/rr04_508.pdf
The following chemicals were incorporated from HBN research:
|
other | 29 | 0 | |
Biocides | incomplete | This compound group has not yet been assigned a structural definition. |
functional use | 381 | 0 | |
Biocidal coatings / biocidal additives (GADSL list) | incomplete | This compound group was populated from the 2016 GADSL list at http://www.gadsl.org/ |
fixed list | 378 | 0 | |
Beryllium inorganic compounds | in progress | This compound group is defined by the SMILES string '[Be]' and subsequently filtered to remove substances containing '[C]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | other | 0 | 2 | |
beryllium compounds with the exception of aluminium beryllium silicates, and with those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex.This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
136 | 21 | ||
BERYLLIUM COMPOUNDS | in progress | This compound group is defined by the SMILES string '[Be]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. This definition is based on the scope of the IARC listing, most recently in monograph 100C: "Synonyms and molecular formulae for beryllium, beryllium–aluminium and beryllium– copper alloys, and certain beryllium compounds are presented in Table 1.1. The list is not exhaustive, nor does it comprise necessarily the most commercially important beryllium-containing substances; rather, it indicates the range of beryllium compounds available." |
element | 139 | 12 | |
Benzodiazepines | incomplete | This compound group has not yet been assigned a structural definition. |
other | 3 | 1 | |
Benzo[b]thiophen-3(2H)-one, (and related compounds) | incomplete | This compound group has not yet been assigned a structural definition. | other | 5 | 1 | |
Benzidine-related compounds / Benzidine derivatives | incomplete | This compound group has not yet been assigned a structural definition. |
103 | 1 | ||
BENZIDINE-BASED DYES | incomplete | This compound group has not yet been assigned a structural definition. | other | 49 | 16 | |
BENZIDINE SALTS | in progress | This compound group is defined by the SMILES string '[CH]1=[CH][C](=[CH][CH]=C1C2=[CH][CH]=[C]([CH]=[CH]2)[ND1])[ND1]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. |
structure | 39 | 8 | |
benzidine based azo dyes 4,4'-diarylazobiphenyl dyes, with the exception of those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
0 | 17 | ||
Benzenesulfonic acid, and other substituted compounds | incomplete | This compound group has not yet been assigned a structural definition. | other | 10 | 1 | |
Benzenedicarboxylic acid, branched and linear alkyl esters | incomplete | This compound group has not yet been assigned a structural definition. | other | 3 | 1 | |
Benzenediamine, N,N'-mixed (phenyl, tolyl and xylyl derivatives of) | incomplete | This compound group has not yet been assigned a structural definition. | other | 2 | 1 | |
Benzene, Halogenated derivatives | incomplete | This compound group has not yet been assigned a structural definition. | other | 23 | 1 | |
barium salts, with the exception of barium sulphate, salts of 1-azo-2-hydroxynaphthalenyl aryl sulphonic acid, and of salts specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
2 | 2 | ||
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. |
548 | 0 | |
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 | 5 |
BARIUM COMPOUNDS | in progress | This compound group is defined by the SMILES string '[Ba]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 52 | 4 | |
Barbiturates | incomplete | This group has not been assigned a structural definition yet. |
0 | 2 | ||
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 | 322 | 1 |
Asbestos Fibers | complete | 06/04/18 | This compound group has not yet been assigned a structural definition. |
other | 8 | 12 |
Asbestos compounds | incomplete | This compound group has not yet been assigned a structural definition. | other | 20 | 12 | |
Arsenous acid salts | in progress | This compound group has not yet been assigned a structural definition. |
other | 2 | 38 | |
ARSENIC, INORGANIC OXIDES | complete | 08/09/18 | This compound group has not yet been assigned a structural definition. | other | 3 | 41 |
arsenic compounds, with the exception of those specified elsewhere in Annex VI of Regulation (EC) No 1272/2008 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
1911 | 34 | ||
Arsenic Compounds, Soluble | incomplete | This compound group was populated from Table 1 of "Arsenic, inorganic and soluble salts Evaluation of health hazards and proposal of a health-based quality criterion for drinking water" Environmental Project No. 1532, 2014. Danish Ministry of the Environment at https://www2.mst.dk/Udgiv/publications/2014/01/978-87-93026-86-5.pdf |
other | 5 | 31 | |
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 | 1567 | 31 |
ARSENIC COMPOUNDS, INORGANIC | in progress | This compound group is defined by the SMILES string '[As]' and subsequently filtered to remove substances containing '[C]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | other | 342 | 38 | |
ARSENIC COMPOUNDS | in progress | This compound group is defined by the SMILES string '[As]'. For more information on SMILES, see https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system. | element | 2198 | 30 | |
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 | 95 | 41 |
Arsenic acid and its salts with the exception of those specified elsewhere in Annex XVII of Regulation (EC) No 1907/2006 | incomplete | This compound group is populated by taking the more general compound group and subtracting the chemicals found in the relevent Annex. |
88 | 42 |