Consensus flow list

2,4,5,2',5'-pentachlorobiphenyl

fo-71f46c21a5a836b9

Identity

Type
Neutral molecule
CAS
37680-73-2
EC
621-393-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for 2,4,5,2',5'-pentachlorobiphenyl

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 LAHWLEDBADHJGA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H5Cl5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H
IUPAC name chemrof:IUPAC_name 2,4,5,2',5'-pentachlorobiphenyl
Molecular formula chemrof:molecular_formula C12H5Cl5
Molecular mass chemrof:molecular_mass 326.437
Monoisotopic mass chemrof:monoisotopic_mass 323.883389, 323.88339
SMILES string chemrof:smiles_string Clc1ccc(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)c1

Known URLs

12

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=37680-73-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:233349 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.150.249 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8038304 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL14041 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/803YVI5BNP enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0246225 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J147.958J enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=156011 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/37807 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/33299007 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27269110 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
1a99cab5-ac0d-457a-9e58-99ac1c446918 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
843b3c57-f9d4-4f45-bc68-73ac49823cf6 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
5ad6a4b0-cfe3-4062-ac92-df6ee9c9347d Environmental → Air → Indoor EF 3.1 kg 2
29cf83f3-7e3d-4107-b83b-1a9cdf342c79 Environmental → Air → Long-term EF 3.1 kg 0
0308e4a7-8481-48ab-8fd5-dad2860c59b7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
473146f3-79c4-43ee-9e3f-fa9ed46295fb Environmental → Air → Unknown EF 3.1 kg 2
5fb52390-ccb0-4135-8f37-9b0e68e5df4b Environmental → Ground → Agricultural EF 3.1 kg 2
fd7505a3-f2a2-4188-8f8d-d8a0a15c0ea3 Environmental → Ground → Non-agricultural EF 3.1 kg 2
34ed29b4-5bb9-4234-8690-6ff347f57fcd Environmental → Ground → Unknown EF 3.1 kg 2
b6e26d8b-690d-4971-b918-aaa9fac116fa Environmental → Water → Long-term EF 3.1 kg 0
43c3c84b-0950-469d-8199-e6ede3364bf4 Environmental → Water → Ocean EF 3.1 kg 2
62a41ff2-f223-41f5-ab64-f1a0f3d79ded Environmental → Water → Surface water EF 3.1 kg 2
666e6213-0012-4b1c-aaa0-82bec034af45 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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