Consensus flow list

Identity

Type
Neutral molecule
CAS
24279-39-8
EC
416-430-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2,6-dichloro-4-trifluoromethylaniline

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ITNMAZSPBLRJLU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H4Cl2F3N/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2H,13H2
IUPAC name chemrof:IUPAC_name 2,6-dichloro-4-trifluoromethylaniline
Molecular formula chemrof:molecular_formula C7H4Cl2F3N
Molecular mass chemrof:molecular_mass 230.016
Monoisotopic mass chemrof:monoisotopic_mass 228.967289
SMILES string chemrof:smiles_string Nc1c(Cl)cc(C(F)(F)F)cc1Cl

Known URLs

7

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=24279-39-8 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.101.536 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.111.627 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID30179011 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.434.002C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/141094 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q69758015 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
adaae8d8-ec79-4955-a484-2c4b421005b7 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
e10e563b-335a-481a-8e71-19df6499db59 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
e8919e90-c88c-4b8e-946a-8c783d0347ed Environmental → Air → Indoor EF 3.1 kg 4
804ce6d4-b18e-44a1-b53e-ae174a8436ad Environmental → Air → Long-term EF 3.1 kg 0
72d41135-5762-4cdb-824e-3c2d565fe782 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
cf93a600-f445-4554-93e4-370569b3185d Environmental → Air → Unknown EF 3.1 kg 4
ca55beae-90b7-46e2-bea7-07ea81724ef8 Environmental → Ground → Agricultural EF 3.1 kg 4
a5d0d60f-d3d8-4698-8508-e97cc2550264 Environmental → Ground → Non-agricultural EF 3.1 kg 4
ed5fca40-b434-40d8-b795-127e50c6ef90 Environmental → Ground → Unknown EF 3.1 kg 4
bd8fab10-e0bf-498b-80e4-bc8488b6bb4c Environmental → Water → Long-term EF 3.1 kg 0
3fda7b50-893b-4c6f-9576-386bc45b6456 Environmental → Water → Ocean EF 3.1 kg 4
4a352fe8-d276-42ae-8d92-3686796bac4e Environmental → Water → Surface water EF 3.1 kg 4
81997fdb-facd-4f54-b4e4-b3fdcbe65f21 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f86bfe52621c937c",
  "prefLabel": [
    {
      "@value": "2,6-dichloro-4-trifluoromethylaniline",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,6-Dichloro-4-(trifluoromethyl)benzenamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=24279-39-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-Amino-3,5-dichlorobenzotrifluoride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenamine, 2,6-dichloro-4-(trifluoromethyl)-",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "p-Toluidine, 2,6-dichloro-α,α,α-trifluoro-",
      "@language": "en",
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      "provenance": {
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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