Consensus flow list

Identity

Type
Molecular complex
CAS
1639-66-3
EC
216-684-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Sodium Dioctyl Sulfosuccinate

Alternative labels

14

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string CUOSYYRDANYHTL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H38O7S.Na/c1-3-5-7-9-11-13-15-26-19(21)17-18(28(23,24)25)20(22)27-16-14-12-10-8-6-4-2;/h18H,3-17H2,1-2H3,(H,23,24,25);
Molecular formula chemrof:molecular_formula C20H38NaO7S
Molecular mass chemrof:molecular_mass 445.574
Monoisotopic mass chemrof:monoisotopic_mass 445.223594
SMILES string chemrof:smiles_string CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)O.[Na]

Known URLs

3

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=1639-66-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.015.168 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/53249634 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
996b5348-7a3b-479e-9ef1-222c726c90b9 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4b25d469-363d-4c84-8bd8-0e81d3f78522 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
c27494ea-6fcd-41e3-a12b-e29929ab6e52 Environmental → Air → Indoor EF 3.1 kg 2
7f7c4085-ed23-4351-afa4-083d50ad432e Environmental → Air → Long-term EF 3.1 kg 0
a8562580-ef0c-413e-835f-4ed0a820328e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
4005ab59-18df-4ca6-a2c6-a08ba0bccde5 Environmental → Air → Unknown EF 3.1 kg 2
47cea274-4329-475d-97cf-292add16d1fd Environmental → Ground → Agricultural EF 3.1 kg 2
e62bd8eb-7033-4306-8847-10bc1b7eb73b Environmental → Ground → Non-agricultural EF 3.1 kg 2
b5c3dfd0-438b-469d-bf11-ca2fc22e1d1b Environmental → Ground → Unknown EF 3.1 kg 2
ac347402-ece0-44ca-a227-37715782b501 Environmental → Water → Long-term EF 3.1 kg 0
4beacb9a-50b4-4f37-8820-83b437c3b2ef Environmental → Water → Ocean EF 3.1 kg 2
c969405f-5cb3-4861-86bf-2b7dc600f9dc Environmental → Water → Surface water EF 3.1 kg 2
0aa664b3-4710-44d8-bee0-8849e695e5fb 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-044770bf4d4d7368",
  "prefLabel": [
    {
      "@value": "Sodium Dioctyl Sulfosuccinate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Butanedioic acid, 2-sulfo-, 1,4-dioctyl ester, sodium salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1639-66-3",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=1639-66-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Butanedioic acid, sulfo-, 1,4-dioctyl ester, sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1639-66-3",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=1639-66-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dioctyl sodiosulfosuccinate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:1639-66-3",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=1639-66-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dioctylsulfosuccinic acid sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "https://commonchemistry.cas.org/detail?cas_rn=1639-66-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "MKC",
      "@language": "en",
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    },
    {
      "@value": "Neocol SW 30",
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    },
    {
      "@value": "Octyl alcohol, sulfosuccinate (1:2) sodium salt",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Penetrating T",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Sodium 1,2-bis(octyloxycarbonyl)-1-ethanesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Sodium di-n-octyl sulfosuccinate",
      "@language": "en",
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      }
    },
    {
      "@value": "Succinic acid, sulfo-, 1,4-dioctyl ester, sodium salt",
      "@language": "en",
      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "Succinic acid, sulfo-, dioctyl ester, Na salt",
      "@language": "en",
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      }
    },
    {
      "@value": "Succinic acid, sulfo-, dioctyl ester, S-sodium salt",
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    },
    {
      "@value": "Texapon DOS",
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  "properties": {
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        {
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          "prov:hadPrimarySource": [
            "CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)O.[Na]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "CUOSYYRDANYHTL-UHFFFAOYSA-N"
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    "https://w3id.org/chemrof/inchi2d_string": {
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    "https://w3id.org/chemrof/molecular_mass": {
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}

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