Diethyl 4,4'-[(3,3'-dichlorobiphenyl-4,4'-diyl)didiazene-2,1-diyl]bis(5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate)

1H-Pyrazole-3-carboxylic acid, 4,4′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[4,5-dihydro-5-oxo-1-phenyl-, 3,3′-diethyl ester
1H-Pyrazole-3-carboxylic acid, 4,4′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[4,5-dihydro-5-oxo-1-phenyl-, diethyl ester
2-Pyrazoline-3-carboxylic acid, 4,4′-(3,3′-dichloro-4,4′-biphenylylenebisazo)bis[5-oxo-1-phenyl-, diethyl ester
Benzidine Red
C.I. Pigment Red 38
Dainichi Fast Red BL
Fanchon Red R 6227
Irgalite Fast Red PY
Irgaplast Red P
Lionol Red B
Piper Red
Pyrazolone Red
Pyrazolone Red (Yellowish) R-6258
Pyrazolone Red B Toner
Pyrazolone Red Y
Rubber Fast Red B
Rubber Fast Red BA
Sanyo Pyrazolone Red
Silogomma Fast Red B
Silotermo Red B
Symuler Fast Pyrazolone Red B
Symuler Fast Pyrazolone Red BE
Symuler Fast Pyrazolone Red BT
Vulcan Fast Red B
Vulcan Fast Red BA
Vulcan Fast Red BA-ND
Vulcan Fast Red BN

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PLYDMIIYRWUYBP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C36H28Cl2N8O6/c1-3-51-35(49)31-29(33(47)45(43-31)23-11-7-5-8-12-23)41-39-27-17-15-21(19-25(27)37)22-16-18-28(26(38)20-22)40-42-30-32(36(50)52-4-2)44-46(34(30)48)24-13-9-6-10-14-24/h5-20,29-30H,3-4H2,1-2H3
IUPAC name chemrof:IUPAC_name	Diethyl 4,4'-[(3,3'-dichlorobiphenyl-4,4'-diyl)didiazene-2,1-diyl]bis(5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate)
Molecular formula chemrof:molecular_formula	C36H28Cl2N8O6
Molecular mass chemrof:molecular_mass	739.576
Monoisotopic mass chemrof:monoisotopic_mass	738.150886
SMILES string chemrof:smiles_string	CCOC(=O)C1=NN(c2ccccc2)C(=O)C1N=Nc1ccc(-c2ccc(N=NC3C(=O)N(c4ccccc4)N=C3C(=O)OCC)c(Cl)c2)cc1Cl

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=6358-87-8	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.026.171	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID20863750	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=16093	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J35.632H	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/95076	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q72499669	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
551d4035-b45f-4e0f-b976-9cc4b50c9396	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
1091d170-ffdc-4d35-b397-a883fe53ea25	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
1ca0c001-f0f5-4368-89ff-a585926acd9b	Environmental → Air → Indoor	EF 3.1	kg	4
a45b37da-a5e5-48de-b4b4-ea4ede3daea6	Environmental → Air → Long-term	EF 3.1	kg	0
3d319176-c04a-4a77-b6fe-8b975f72ac66	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
d126e8ae-8b76-40a2-bab3-b73143664adc	Environmental → Air → Unknown	EF 3.1	kg	4
2f139493-5dff-404f-9533-16f6ea2a2180	Environmental → Ground → Agricultural	EF 3.1	kg	4
045f463c-9caf-4b1e-8fd3-da3babf7a975	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
adef0889-85d4-49c3-82ca-262295e27e90	Environmental → Ground → Unknown	EF 3.1	kg	4
ae2a1aae-a2a2-4c30-964b-0ca94a34965e	Environmental → Water → Long-term	EF 3.1	kg	0
3b083b4d-a8c2-4a49-a172-1607f6f31dc4	Environmental → Water → Ocean	EF 3.1	kg	4
4e1f69f0-79d6-4618-b922-e6e551fbb96a	Environmental → Water → Surface water	EF 3.1	kg	4
4a288c1c-5090-43ec-ae74-be48f9143c37	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-24f6c4c1dbf87dfa",
  "prefLabel": [
    {
      "@value": "Diethyl 4,4'-[(3,3'-dichlorobiphenyl-4,4'-diyl)didiazene-2,1-diyl]bis(5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate)",
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  ],
  "altLabel": [
    {
      "@value": "1H-Pyrazole-3-carboxylic acid, 4,4′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(2,1-diazenediyl)]bis[4,5-dihydro-5-oxo-1-phenyl-, 3,3′-diethyl ester",
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      }
    },
    {
      "@value": "1H-Pyrazole-3-carboxylic acid, 4,4′-[(3,3′-dichloro[1,1′-biphenyl]-4,4′-diyl)bis(azo)]bis[4,5-dihydro-5-oxo-1-phenyl-, diethyl ester",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Pyrazoline-3-carboxylic acid, 4,4′-(3,3′-dichloro-4,4′-biphenylylenebisazo)bis[5-oxo-1-phenyl-, diethyl ester",
      "@language": "en",
      "@lang": "en",
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    },
    {
      "@value": "Benzidine Red",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "C.I. Pigment Red 38",
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      }
    },
    {
      "@value": "Dainichi Fast Red BL",
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      }
    },
    {
      "@value": "Fanchon Red R 6227",
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      }
    },
    {
      "@value": "Irgalite Fast Red PY",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Irgaplast Red P",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Lionol Red B",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Piper Red",
      "@language": "en",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=6358-87-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pyrazolone Red",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pyrazolone Red (Yellowish) R-6258",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pyrazolone Red B Toner",
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      }
    },
    {
      "@value": "Pyrazolone Red Y",
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      }
    },
    {
      "@value": "Rubber Fast Red B",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Rubber Fast Red BA",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sanyo Pyrazolone Red",
      "@language": "en",
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    {
      "@value": "Silogomma Fast Red B",
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    },
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      "@value": "Silotermo Red B",
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    },
    {
      "@value": "Symuler Fast Pyrazolone Red B",
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    {
      "@value": "Symuler Fast Pyrazolone Red BE",
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    {
      "@value": "Symuler Fast Pyrazolone Red BT",
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    {
      "@value": "Vulcan Fast Red B",
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    },
    {
      "@value": "Vulcan Fast Red BA",
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      }
    },
    {
      "@value": "Vulcan Fast Red BA-ND",
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    },
    {
      "@value": "Vulcan Fast Red BN",
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  "properties": {
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            "CCOC(=O)C1=NN(c2ccccc2)C(=O)C1N=Nc1ccc(-c2ccc(N=NC3C(=O)N(c4ccccc4)N=C3C(=O)OCC)c(Cl)c2)cc1Cl"
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    },
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}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Diethyl 4,4'-[(3,3'-dichlorobiphenyl-4,4'-diyl)didiazene-2,1-diyl]bis(5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate)

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

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