Consensus flow list

4,4'-dichlorobiphenyl

fo-8e121638614dae64

Identity

Type
Neutral molecule
CAS
2050-68-2
EC
218-095-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for 4,4'-dichlorobiphenyl

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 YTBRNEUEFCNVHC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H8Cl2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H
IUPAC name chemrof:IUPAC_name 4,4'-dichlorobiphenyl
Molecular formula chemrof:molecular_formula C12H8Cl2
Molecular mass chemrof:molecular_mass 223.102
Monoisotopic mass chemrof:monoisotopic_mass 222.000306, 222.00031
SMILES string chemrof:smiles_string Clc1ccc(-c2ccc(Cl)cc2)cc1

Known URLs

16

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=2050-68-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34364 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.016.452 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0022515 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=1141 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL14295 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/DOF6S5DT2R enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.868I enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C14248 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C14248 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=54971 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/16308 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/22755535 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24369744 enrich_references.chebi_xrefs
reaxys reaxys:2044700 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27116020 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
8181e990-dba0-4e4f-bef3-83b4ab5a224d Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4978a72c-7823-409b-8600-69f0ea95cbf0 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
62fdc89d-f806-4f7a-8bd1-7f060fecfeeb Environmental → Air → Indoor EF 3.1 kg 2
6f42df09-6acb-4f55-bc02-0e7e460b9b09 Environmental → Air → Long-term EF 3.1 kg 0
91c10f48-f23c-48d1-a506-0ac61e99c1e9 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
a258094c-714d-4b90-8166-be23b9c82be8 Environmental → Air → Unknown EF 3.1 kg 2
0987a236-e417-40c5-baaa-a5bf67d43289 Environmental → Ground → Agricultural EF 3.1 kg 2
2488105d-0f49-48d3-95c1-9527940310b1 Environmental → Ground → Non-agricultural EF 3.1 kg 2
cc16e3e8-4b04-46c6-a4a1-56be986a23e9 Environmental → Ground → Unknown EF 3.1 kg 2
d70985d3-5fd2-4e08-b46d-ad155da74831 Environmental → Water → Long-term EF 3.1 kg 0
028efd65-aa86-48aa-80af-288c979ea44f Environmental → Water → Ocean EF 3.1 kg 2
ee36d519-a32d-4e70-a623-4d53930586b0 Environmental → Water → Surface water EF 3.1 kg 2
eb6e37a7-ad32-44ff-b201-e6f53b86bb0a 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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