Consensus flow list

Identity

Type
Neutral molecule
CAS
6486-23-3
EC
229-355-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-chlorophenyl)-3-oxobutanamide

Alternative labels

89

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string QTSNFLIDNYOATQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H12Cl2N4O4/c1-9(23)15(16(24)19-12-5-3-2-4-11(12)18)21-20-13-7-6-10(17)8-14(13)22(25)26/h2-8,15H,1H3,(H,19,24)
IUPAC name chemrof:IUPAC_name 2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-N-(2-chlorophenyl)-3-oxobutanamide
Molecular formula chemrof:molecular_formula C16H12Cl2N4O4
Molecular mass chemrof:molecular_mass 395.202
Monoisotopic mass chemrof:monoisotopic_mass 394.02356
SMILES string chemrof:smiles_string CC(=O)C(N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Cl

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=6486-23-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.026.687 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID40863873 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=17264 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/L885GOC9B6 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.095B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/94326 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27282827 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Pigment_Yellow_3 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
0fdf8a11-513e-4e44-819c-2bf5c574e11d Environmental → Air → Aircraft cruise height EF 3.1 kg 4
27a88ad6-3936-4a68-8783-f83ba4447b05 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
a1fd6bf8-0422-4d0c-abcc-1d097e11dbfc Environmental → Air → Indoor EF 3.1 kg 4
8bf86373-4b70-4714-a298-4236b3188c0e Environmental → Air → Long-term EF 3.1 kg 0
54f8cac8-e65f-4ee6-a471-e035e0d914ec Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
08fd5805-97f3-4b05-a5c8-173e6ef33bed Environmental → Air → Unknown EF 3.1 kg 4
42c8e71a-885e-4833-99bd-aefd255323f5 Environmental → Ground → Agricultural EF 3.1 kg 4
39020742-3b84-4e09-aef7-9bfa0d3a666d Environmental → Ground → Non-agricultural EF 3.1 kg 4
33ecbcaf-9ca9-4d24-9cc0-df0e1d7df5b4 Environmental → Ground → Unknown EF 3.1 kg 4
acc4ae06-98bd-47bf-b22e-4e6997246477 Environmental → Water → Long-term EF 3.1 kg 0
dd84c3e0-8ff2-4d11-97e2-2eebfa94cc52 Environmental → Water → Ocean EF 3.1 kg 4
6d454ee3-5432-4636-95b1-68c2435295d7 Environmental → Water → Surface water EF 3.1 kg 4
3b06672c-7c52-4af1-8881-f06f1aaf1c22 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-e07057448aa95ae1",
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    {
      "@value": "2-[(4-chloro-2-nitrophenyl)diazenyl]-n-(2-chlorophenyl)-3-oxobutanamide",
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        "prov:wasDerivedFrom": "legacy name field"
      }
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  ],
  "altLabel": [
    {
      "@value": "2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-N-(2-chlorophenyl)-3-oxobutanamide",
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      }
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    {
      "@value": "Acetoacetanilide, 2′-chloro-2-(4-chloro-2-nitrophenylazo)-",
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