Consensus flow list

Identity

Type
Chemical salt
CAS
587-98-4
EC
209-608-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Sodium 3-(p-anilinophenylazo)benzenesulphonate

Alternative labels

105

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string NYGZLYXAPMMJTE-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string InChI=1S/C18H15N3O3S.Na/c22-25(23,24)18-8-4-7-17(13-18)21-20-16-11-9-15(10-12-16)19-14-5-2-1-3-6-14;/h1-13,19H,(H,22,23,24);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Sodium 3-(p-anilinophenylazo)benzenesulphonate
Molecular formula chemrof:molecular_formula C18H14N3NaO3S, C18H14N3O3S.Na
Molecular mass chemrof:molecular_mass 375.385
Monoisotopic mass chemrof:monoisotopic_mass 375.065357, 375.06536
SMILES string chemrof:smiles_string O=S(=O)([O-])c1cccc(N=Nc2ccc(Nc3ccccc3)cc2)c1.[Na+]

Known URLs

16

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=587-98-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:87235 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.008.736 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.281.418 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.281.421 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.281.425 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.281.426 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5041722 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7SPF5O5BW8 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.744J enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/3935589 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/21112608 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21470774 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24748737 enrich_references.chebi_xrefs
reaxys reaxys:3831568 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27159458 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
96839963-5ffa-466d-8591-a2e8d92725e0 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4cbd8420-3b22-4338-86e3-fbeff963549d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
a1933641-2749-43b0-8e4b-0ab3a3738adf Environmental → Air → Indoor EF 3.1 kg 2
3e9c04ef-9f2f-448c-810f-91046e6c2236 Environmental → Air → Long-term EF 3.1 kg 0
eece4e7e-9e07-454c-a099-df423cf965a3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
c00453e3-7ce9-4745-960d-2353850318a0 Environmental → Air → Unknown EF 3.1 kg 2
28e92bbb-3f78-4ae7-9b45-a14c9da5603a Environmental → Ground → Agricultural EF 3.1 kg 2
c5773dac-d1f9-47b8-b22d-442ff8a4b614 Environmental → Ground → Non-agricultural EF 3.1 kg 2
8e004003-87a2-4728-9217-149ec7b957c9 Environmental → Ground → Unknown EF 3.1 kg 2
75cfe645-aa13-4350-bed9-93e035e504fa Environmental → Water → Long-term EF 3.1 kg 0
c7c8551a-d86d-43c4-9963-7ce8b0075fbf Environmental → Water → Ocean EF 3.1 kg 2
4d26e8b0-7e68-4953-a1b8-fc24447ce464 Environmental → Water → Surface water EF 3.1 kg 2
5854ded8-667d-4925-8def-d9a112bfd503 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
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  "altLabel": [
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    },
    {
      "@value": "Aizen Metanil Yellow",
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    {
      "@value": "Amacid Yellow M",
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    },
    {
      "@value": "Benzenesulfonic acid, 3-[2-[4-(phenylamino)phenyl]diazenyl]-, sodium salt (1:1)",
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      }
    },
    {
      "@value": "Benzenesulfonic acid, 3-[[4-(phenylamino)phenyl]azo]-, monosodium salt",
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      }
    },
    {
      "@value": "Benzenesulfonic acid, m-(p-anilinophenylazo)-, sodium salt",
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    },
    {
      "@value": "Borunil Yellow A-G",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Brasilan Metanil Yellow",
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        ],
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      }
    },
    {
      "@value": "BTK Metanil Yellow",
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    },
    {
      "@value": "Bucacid Metanil Yellow",
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      }
    },
    {
      "@value": "C Ext. Yellow 10",
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        ],
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      }
    },
    {
      "@value": "C.I. Acid Yellow 36",
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    },
    {
      "@value": "C.I. Acid Yellow 36 monosodium salt",
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    },
    {
      "@value": "C.I. Acid Yellow 36, monosodium salt",
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      }
    },
    {
      "@value": "Calcocid Yellow MXXX",
      "@language": "en",
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    },
    {
      "@value": "Cogilor Yellow 114.12",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Colorosacid Yellow Methanilic",
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      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=587-98-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Conacid Yellow CK",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=587-98-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Diacid Metanil Yellow",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "https://commonchemistry.cas.org/detail?cas_rn=587-98-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dinacid Metanil Yellow",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=587-98-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Duasyn Acid Yellow C 01",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "https://commonchemistry.cas.org/detail?cas_rn=587-98-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dyacid Yellow M",
      "@language": "en",
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      }
    },
    {
      "@value": "Dycosacid Golden Yellow G",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Dycosacid Metanil Yellow MT",
      "@language": "en",
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    },
    {
      "@value": "Dycosacid Yellow MT",
      "@language": "en",
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      }
    },
    {
      "@value": "Egacid Yellow M",
      "@language": "en",
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      }
    },
    {
      "@value": "Egacid Yellow MA",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Eniacid Metanil Yellow GN",
      "@language": "en",
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