Consensus flow list

Identity

Type
NeutralMolecule
CAS
19719-28-9
EC
243-248-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for (2,4-dichlorophenyl)acetic Acid

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GXMWLJKTGBZMBH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H6Cl2O2/c9-6-2-1-5(3-8(11)12)7(10)4-6/h1-2,4H,3H2,(H,11,12)
IUPAC name chemrof:IUPAC_name (2,4-dichlorophenyl)acetic Acid
Molecular formula chemrof:molecular_formula C8H6Cl2O2
Molecular mass chemrof:molecular_mass 205.04
Monoisotopic mass chemrof:monoisotopic_mass 203.974485
SMILES string chemrof:smiles_string O=C(O)Cc1ccc(Cl)cc1Cl

Known URLs

9

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=19719-28-9 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.039.302 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4041363 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=54853 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185822 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/15N730ND47 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.084F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/88209 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27251731 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
4ebd5b35-cd52-4b77-8af7-218615968bdd Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3fd6d146-16b0-4d7a-bb84-e4d6b51c4940 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
80272504-a863-4366-8af4-e7daaf5f1965 Environmental → Air → Indoor EF 3.1 kg 2
ebe4e3b3-c1f2-4321-ab2a-db274a88a937 Environmental → Air → Long-term EF 3.1 kg 0
5d278af0-a7ca-4c4e-8baf-6bee4915f07c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
eb2ef61a-7c1d-41b1-b107-cc99303faa62 Environmental → Air → Unknown EF 3.1 kg 2
77618c66-e7eb-4125-b681-c58d96d020ea Environmental → Ground → Agricultural EF 3.1 kg 2
c98d470d-c4c8-4b78-af03-ee66d86a038d Environmental → Ground → Non-agricultural EF 3.1 kg 2
246c9e73-2ab7-4c14-bb37-938aff2467d3 Environmental → Ground → Unknown EF 3.1 kg 2
1af29b5a-5266-478d-8b5b-a895ff003329 Environmental → Water → Long-term EF 3.1 kg 0
e0bb47fa-5e10-41b1-9618-4858991d9a68 Environmental → Water → Ocean EF 3.1 kg 2
80d77651-1c01-45cb-874f-8386bf87dbdc Environmental → Water → Surface water EF 3.1 kg 2
8179daa4-9789-43bf-8c96-cc9cd082880d 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-e7fd12437694e468",
  "prefLabel": [
    {
      "@value": "(2,4-dichlorophenyl)acetic Acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,4-Dichlorobenzeneacetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4-Dichlorophenylacetic acid",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "2-(2,4-Dichlorophenyl)acetic acid",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Acetic acid, (2,4-dichlorophenyl)-",
      "@language": "en",
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    },
    {
      "@value": "Benzeneacetic acid, 2,4-dichloro-",
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}

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