Consensus flow list

2,2',4,4'-tetrachlorobiphenyl

fo-37b0d5847f35cbed

Identity

Type
NeutralMolecule
CAS
2437-79-8
EC
219-444-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for 2,2',4,4'-tetrachlorobiphenyl

What it is used for

2

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI
persistent organic pollutant CHEBI:77853 Any environmental contaminant that is resistant to environmental degradation through photolytic, biological or chemical processes. Such substances can have significant impact on health and the environment, as they persist in the environment, bioaccumulate in animal tissue and so biomagnify in food chains. ChEBI

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string QORAVNMWUNPXAO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H6Cl4/c13-7-1-3-9(11(15)5-7)10-4-2-8(14)6-12(10)16/h1-6H
IUPAC name chemrof:IUPAC_name 2,2',4,4'-tetrachlorobiphenyl
Molecular formula chemrof:molecular_formula C12H6Cl4
Molecular mass chemrof:molecular_mass 291.992
Monoisotopic mass chemrof:monoisotopic_mass 289.92236, 289.922361
SMILES string chemrof:smiles_string Clc1ccc(-c2ccc(Cl)cc2Cl)c(Cl)c1

Known URLs

14

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
beilstein beilstein:2052543 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=2437-79-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34204 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.017.677 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0022513 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL137283 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4470AQR07D enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0245370 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J134.536B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C14247 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C14247 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=54934 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/17097 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27115901 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
a5fa4721-9f78-4ac7-bee8-3a9ba0599129 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
20747426-032d-45cd-82f2-2281e84e32b7 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
eae9de9a-406f-48c8-a187-2bb8ed5532d2 Environmental → Air → Indoor EF 3.1 kg 2
46291107-ebff-45a6-ad2f-5ede29bc8e5f Environmental → Air → Long-term EF 3.1 kg 0
dda84302-bdf4-4a9e-8f34-49e7c150ae82 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
cf721605-c51c-4271-8573-86582f1be147 Environmental → Air → Unknown EF 3.1 kg 2
0750552d-917f-4fd1-842b-386bd7f0fb20 Environmental → Ground → Agricultural EF 3.1 kg 2
913cb580-3b7f-4190-a0d4-23182374c557 Environmental → Ground → Non-agricultural EF 3.1 kg 2
2dff50df-0b61-4fea-88bc-9ac0b6376868 Environmental → Ground → Unknown EF 3.1 kg 2
e009baa4-78cf-4389-8034-f427d0908521 Environmental → Water → Long-term EF 3.1 kg 0
48ae6b4c-6d82-44da-a0cf-d35f91e2a7cf Environmental → Water → Ocean EF 3.1 kg 2
f01d1174-910b-44fa-b1c3-fdaf3de369e5 Environmental → Water → Surface water EF 3.1 kg 2
4d9b72b8-b47e-43b1-9b27-cb9a3e25795c Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
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