Consensus flow list

Identity

Type
ChemicalSalt
CAS
7491-09-0
EC
231-308-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Potassium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate

Alternative labels

11

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string CACRHRQTJDKAPJ-UHFFFAOYSA-M, SRQKEEPVRWNRQZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H38O7S.K/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;/h16-18H,5-15H2,1-4H3,(H,23,24,25);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Potassium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate
Molecular formula chemrof:molecular_formula C20H37KO7S, C20H38KO7S
SMILES string chemrof:smiles_string CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[K+]

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=7491-09-0 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/87063852 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
139fb115-caa9-4564-a580-c51d5d179e2e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
e88894d6-4c63-4668-855d-bac29f6bc418 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
00522cbe-0581-4dc3-88d8-7b4924606e89 Environmental → Air → Indoor EF 3.1 kg 4
bf9a1878-033f-4c5f-97a9-b9f82bcad098 Environmental → Air → Long-term EF 3.1 kg 0
5d9d018a-aac5-4f85-b16b-66b306beb2aa Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
e219c7fc-1887-4812-b14d-4908a17f2d7f Environmental → Air → Unknown EF 3.1 kg 4
f3199b77-0676-4915-bdbe-e5b4ea580fcd Environmental → Ground → Agricultural EF 3.1 kg 4
0c40c331-0489-4f5b-9b82-a4d6d7b09c62 Environmental → Ground → Non-agricultural EF 3.1 kg 4
d7b0ccd8-c49d-4778-a804-c47593a4afe2 Environmental → Ground → Unknown EF 3.1 kg 4
9f1e6d5e-76fb-434c-969b-75580aa25ec9 Environmental → Water → Long-term EF 3.1 kg 0
20ae539f-d4c2-4aa9-b105-32832434b447 Environmental → Water → Ocean EF 3.1 kg 4
f475ad10-b0cd-4247-a70d-e4458f057cc7 Environmental → Water → Surface water EF 3.1 kg 4
408b01ab-12b1-4a2d-9110-5454726e8a7e Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-b36dad06a22bf29c",
  "prefLabel": [
    {
      "@value": "Potassium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate",
      "@language": "en",
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      }
    }
  ],
  "altLabel": [
    {
      "@value": "Bis(2-ethylhexyl) potassium sulfosuccinate",
      "@language": "en",
      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "Bis-2-ethylhexyl-2-sulfobutane-1,4-dioate potassium salt",
      "@language": "en",
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    },
    {
      "@value": "Butanedioic acid, 2-sulfo-, 1,4-bis(2-ethylhexyl) ester, potassium salt (1:1)",
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    {
      "@value": "Dioctyl potassium sulfosuccinate",
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      "@value": "Rectalad Enema",
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    {
      "@value": "Succinic acid, sulfo-, 1,4-bis(2-ethylhexyl) ester, potassium salt",
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    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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}

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