Consensus flow list

Identity

Type
ChemicalSalt
CAS
824-39-5
EC
212-527-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Sodium 2-nitrophenolate

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SCFXRRMXMMHURF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H5NO3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H;
Molecular formula chemrof:molecular_formula C6H5NNaO3
Molecular mass chemrof:molecular_mass 162.1
Monoisotopic mass chemrof:monoisotopic_mass 162.016712
SMILES string chemrof:smiles_string C1=CC=C(C(=C1)[N+](=O)[O-])O.[Na]

Known URLs

2

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=824-39-5 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/56923617 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
4e1250dd-7207-453a-a20f-ca2881cc176e Environmental → Air → Aircraft cruise height EF 3.1 kg 2
be1082dc-b13a-4f08-85a0-cbce7eff2b60 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
2b756d6c-413a-403a-affe-840cff41d64e Environmental → Air → Indoor EF 3.1 kg 2
00d08871-e86e-4a3c-911d-dfb07b23b9bd Environmental → Air → Long-term EF 3.1 kg 0
1a95aab0-636f-41b8-828e-727e628df92b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
eabc1606-c99a-4cf8-98d9-fe3ca38ce90b Environmental → Air → Unknown EF 3.1 kg 2
a8918f2f-3394-4905-b766-0829c6857262 Environmental → Ground → Agricultural EF 3.1 kg 2
45b2c9bf-6e38-4a2b-80d3-62da75ee0bb4 Environmental → Ground → Non-agricultural EF 3.1 kg 2
f6d069ee-838f-48fc-a1ca-4638e9df7d43 Environmental → Ground → Unknown EF 3.1 kg 2
1007a539-6995-47f6-8353-8c93231ccb1f Environmental → Water → Long-term EF 3.1 kg 0
61eddf41-9e65-457e-92bd-0ab08ddd4631 Environmental → Water → Ocean EF 3.1 kg 2
aca94c30-c8f0-478c-9881-22048eba7c45 Environmental → Water → Surface water EF 3.1 kg 2
5147ea9b-04a5-47d5-b08f-65d5eab3833f Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-21869b00e2f670cd",
  "prefLabel": [
    {
      "@value": "Sodium 2-nitrophenolate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(o-Nitrophenolato)sodium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Nitrophenol sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Nitrophenol sodium salt",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phenol, 2-nitro-, sodium salt",
      "@language": "en",
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    },
    {
      "@value": "Phenol, o-nitro-, sodium deriv.",
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    },
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    },
    {
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    },
    {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium, (o-nitrophenoxy)-",
      "@language": "en",
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      ],
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    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "SCFXRRMXMMHURF-UHFFFAOYSA-N"
      ],
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      "rdfs:label": "InChIKey",
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "@value": [
        "C1=CC=C(C(=C1)[N+](=O)[O-])O.[Na]"
      ],
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      },
      "rdfs:label": "SMILES",
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      "attested_by": {
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      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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