Consensus flow list

Identity

Type
Neutral molecule
CAS
583-78-8
EC
209-520-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2,5-dichlorophenol

Alternative labels

2

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RANCECPPZPIPNO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H4Cl2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
IUPAC name chemrof:IUPAC_name 2,5-dichlorophenol
Molecular formula chemrof:molecular_formula C6H4Cl2O
Molecular mass chemrof:molecular_mass 163.003
Monoisotopic mass chemrof:monoisotopic_mass 161.96392
SMILES string chemrof:smiles_string Oc1cc(Cl)ccc1Cl

Known URLs

22

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=583-78-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:27929 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.008.657 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0439 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7025003 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6296 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1565192 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3B11G9AKBA enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0041800 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.634I enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C06602 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C06602 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=49543 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=25-DICHLOROPHENOL enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/66 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2020 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/19247685 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/9051121 enrich_references.chebi_xrefs
reaxys reaxys:1907692 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0545 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q13427538 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/2,5-Dichlorophenol enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
966bf2d6-4301-445d-b1ad-82c9197fe534 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d09ce8bf-68b6-42ca-b175-aecdf8335c0a Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
f9dd0c2d-ee41-410d-b7d8-230e7c33d44e Environmental → Air → Indoor EF 3.1 kg 2
3a99fcb2-5429-491e-9951-83871b34d9e3 Environmental → Air → Long-term EF 3.1 kg 0
31b9e079-b637-44d6-8af3-99a7dd6461ef Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
2e9854f7-397d-48a1-97e8-61a4b37d4cca Environmental → Air → Unknown EF 3.1 kg 2
b873157e-2d02-491d-a248-58cf343f507a Environmental → Ground → Agricultural EF 3.1 kg 2
1aa8eb94-a6a5-424f-9406-323c4e548542 Environmental → Ground → Non-agricultural EF 3.1 kg 2
1ab9c467-dfb2-4589-b47b-f8db33cc0038 Environmental → Ground → Unknown EF 3.1 kg 2
f3cbfb4a-6c05-4bcd-b982-a0295f9326a0 Environmental → Water → Long-term EF 3.1 kg 0
4df11044-f061-4f52-bd71-85c9c461f8ef Environmental → Water → Ocean EF 3.1 kg 2
02e0fe1f-c525-49b4-a994-19d2fd4e7323 Environmental → Water → Surface water EF 3.1 kg 2
bedb2416-dbee-41ea-8dfc-c590525dca3c Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-2fcf967ea07e3c70",
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  ],
  "altLabel": [
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Phenol, 2,5-dichloro-",
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      "@value": "A dichlorophenol with the chloro substituents at positions 2 and 5.",
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  ],
  "@type": [
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  ]
}

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