Consensus flow list

Identity

Type
Neutral molecule
CAS
90-51-7
EC
202-000-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 6-amino-4-hydroxynaphthalene-2-sulfonic Acid

Alternative labels

16

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string HBZVNWNSRNTWPS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15)
IUPAC name chemrof:IUPAC_name 6-amino-4-hydroxynaphthalene-2-sulfonic Acid
Molecular formula chemrof:molecular_formula C10H9NO4S
Molecular mass chemrof:molecular_mass 239.252
Monoisotopic mass chemrof:monoisotopic_mass 239.025229
SMILES string chemrof:smiles_string Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1

Known URLs

12

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=90-51-7 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.819 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.083.290 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0026547 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=31508 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8630 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3087995 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0PLB93P56X enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.321D enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7022 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=020198 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27237069 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
195f3632-acc4-40cb-bcd9-bd2c03a99bb8 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
29b58d84-cb57-4f96-ace2-608f382b0cee Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
1b0a7d41-7902-4371-94ba-770a42e16813 Environmental → Air → Indoor EF 3.1 kg 2
c3f020d4-f9c0-4dad-ae6e-0d2834f5df0a Environmental → Air → Long-term EF 3.1 kg 0
0af18726-c9d6-490a-8739-8bb95668a6b3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
3efcf98e-e0ba-4008-a99b-75ff65e87598 Environmental → Air → Unknown EF 3.1 kg 2
744cd8d0-59a9-4d9f-afd6-36453cf8b844 Environmental → Ground → Agricultural EF 3.1 kg 2
401d2f17-bc5a-448e-9cd1-0fbd8024f1a6 Environmental → Ground → Non-agricultural EF 3.1 kg 2
bc08c13a-e54b-4736-a60e-9407bb6e779e Environmental → Ground → Unknown EF 3.1 kg 2
184fc6dc-dbdd-41be-a846-38eb7970daf5 Environmental → Water → Long-term EF 3.1 kg 0
81b0f59f-80d5-44a1-b415-a5708ae35371 Environmental → Water → Ocean EF 3.1 kg 2
f66a3222-74f0-463c-a373-68e8ce72a33e Environmental → Water → Surface water EF 3.1 kg 2
0b2de792-a816-434e-866c-cbd580980fc3 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-a101fcc01f1c3403",
  "prefLabel": [
    {
      "@value": "6-amino-4-hydroxynaphthalene-2-sulfonic Acid",
      "@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": "1-Naphthol-3-sulfonic acid, 7-amino-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=90-51-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Naphthol-7-amino-3-sulfonic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Amino-6-sulfo-8-naphthol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "2-Amino-8-hydroxy-6-sulfonaphthalene",
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    },
    {
      "@value": "2-Amino-8-hydroxynaphthalene-6-sulfonic acid",
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    },
    {
      "@value": "2-Naphthalenesulfonic acid, 6-amino-4-hydroxy-",
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    },
    {
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    },
    {
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    },
    {
      "@value": "Aminonaphthol sulfonic acid γ",
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    },
    {
      "@value": "C.I. Developer 3",
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          "https://commonchemistry.cas.org/detail?cas_rn=90-51-7"
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      }
    },
    {
      "@value": "Gamma acid",
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    },
    {
      "@value": "Y acid",
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      }
    },
    {
      "@value": "γ-Acid",
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C10H9NO4S"
      ],
      "attested_by": {
        "C10H9NO4S": [
          "enrich_references.pubchem_semantic",
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      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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        {
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          "prov:hadPrimarySource": [
            "Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
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      "provenance": [
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        },
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15)"
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      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "attested_by": {
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  },
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