Consensus flow list

Identity

Type
Chemical salt
CAS
127-39-9
EC
204-839-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Sodium 1,4-diisobutoxy-1,4-dioxobutane-2-sulfonate

Alternative labels

20

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string FXZAUBIBKADOBA-UHFFFAOYSA-N, NTWXWSVUSTYPJH-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string InChI=1S/C12H22O7S.Na/c1-8(2)6-18-11(13)5-10(20(15,16)17)12(14)19-7-9(3)4;/h8-10H,5-7H2,1-4H3,(H,15,16,17);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Sodium 1,4-diisobutoxy-1,4-dioxobutane-2-sulfonate
Molecular formula chemrof:molecular_formula C12H21NaO7S, C12H22NaO7S
SMILES string chemrof:smiles_string CC(C)COC(=O)CC(C(=O)OCC(C)C)S(=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=127-39-9 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/53445250 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
f5e8d95b-9500-42f2-ac70-196b68915fe2 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
4268b1a7-4522-49ed-bb40-47ee08e1027a Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d0621327-fd6c-4fca-bdda-8dd2037a0a04 Environmental → Air → Indoor EF 3.1 kg 4
8636049e-106d-4e8d-8df6-7f7effaa7e82 Environmental → Air → Long-term EF 3.1 kg 0
65053b4b-76d3-447b-ab0d-8e54bbba29e8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
28b81e72-c348-4923-845d-39e914553e74 Environmental → Air → Unknown EF 3.1 kg 4
e0ec116b-0f01-4d01-b1e9-849a58265482 Environmental → Ground → Agricultural EF 3.1 kg 4
36be75f6-5def-4cb8-85fa-478d55206d2c Environmental → Ground → Non-agricultural EF 3.1 kg 4
6863ca8d-b43a-42e7-b64c-92ff37542e7f Environmental → Ground → Unknown EF 3.1 kg 4
926a906f-2457-4f01-ab4a-53bb893b63b5 Environmental → Water → Long-term EF 3.1 kg 0
8ece4f93-b3d8-4110-beb1-7042fcb2ae15 Environmental → Water → Ocean EF 3.1 kg 4
98e70d3f-80b1-444d-8563-817bf20af1f1 Environmental → Water → Surface water EF 3.1 kg 4
f7a955bf-be15-46cb-80ff-b39630db87e5 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f6dfe82ab0730f59",
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    {
      "@value": "Sodium 1,4-diisobutoxy-1,4-dioxobutane-2-sulfonate",
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  "altLabel": [
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    {
      "@value": "Aerosol IB 45",
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    {
      "@value": "Alphasol IB",
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      }
    },
    {
      "@value": "Butanedioic acid, 2-sulfo-, 1,4-bis(2-methylpropyl) ester, sodium salt (1:1)",
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      "@value": "Butanedioic acid, sulfo-, 1,4-bis(2-methylpropyl) ester, sodium salt",
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      }
    },
    {
      "@value": "Di-2-methylpropyl sulfosuccinate sodium salt",
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    },
    {
      "@value": "Diisobutyl 2-sulfobutane-1,4-dioate sodium salt",
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    },
    {
      "@value": "Diisobutyl sodiosulfosuccinate",
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    },
    {
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    },
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    },
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    },
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}

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