Consensus flow list

Identity

Type
Chemical salt
CAS
27213-90-7
EC
248-326-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Sodium 2,3-diisobutylnaphthalene-1-sulfonate

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string PYODKQIVQIVELM-UHFFFAOYSA-M, YAKAZXMHQWVJDZ-SNVJKNOHSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H24O3S.Na/c1-12(2)9-15-11-14-7-5-6-8-16(14)18(22(19,20)21)17(15)10-13(3)4;/h5-8,11-13H,9-10H2,1-4H3,(H,19,20,21);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Sodium 2,3-diisobutylnaphthalene-1-sulfonate
Molecular formula chemrof:molecular_formula C14H20NaO3S, C18H23NaO3S
SMILES string chemrof:smiles_string CC(C)Cc1cc2ccccc2c(S(=O)(=O)[O-])c1CC(C)C.[Na+]

Known URLs

8

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=27213-90-7 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=29256-81-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.043.919 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.045.019 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID30951854 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/169434456 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/23663678 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q82930301 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
664af599-6693-485e-bd09-bc7427e8dc1b Environmental → Air → Aircraft cruise height EF 3.1 kg 4
f5b16964-6fc8-4f0a-9091-f98ea5629358 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
b7f476f3-a667-4d4e-b3e0-45a0f2be927e Environmental → Air → Indoor EF 3.1 kg 4
4754a309-cb5d-4f85-84bb-25f2a5a2cfca Environmental → Air → Long-term EF 3.1 kg 0
1a862b13-f87f-4286-87c4-19d2e4c2b77b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
535ac580-f4d4-4670-a1a3-0f8f14561480 Environmental → Air → Unknown EF 3.1 kg 4
9d2dd87d-2875-4e2d-a7ff-ea9d7098e616 Environmental → Ground → Agricultural EF 3.1 kg 4
cf302c10-4f1b-4354-9915-84891db1b16a Environmental → Ground → Non-agricultural EF 3.1 kg 4
83d83fad-5f12-4379-afb3-9b8bcd14877f Environmental → Ground → Unknown EF 3.1 kg 4
99ab7cec-5e26-4304-abd0-cd64a7527a9f Environmental → Water → Long-term EF 3.1 kg 0
4c933b60-a30b-4c95-89fe-ac0ca5e5bf49 Environmental → Water → Ocean EF 3.1 kg 4
a2471c93-1d48-47b9-84b5-0ae796000a44 Environmental → Water → Surface water EF 3.1 kg 4
af906fd6-654a-422a-81d4-ad2e682b1d87 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-b68ad03a8cfd2bb7",
  "prefLabel": [
    {
      "@value": "Sodium 2,3-diisobutylnaphthalene-1-sulfonate",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
    {
      "@value": "Diisobutylnaphthalenesulfonic acid sodium salt",
      "@language": "en",
      "@lang": "en",
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      }
    },
    {
      "@value": "Erkantol BX",
      "@language": "en",
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    },
    {
      "@value": "Naphthalenesulfonic acid, bis(2-methylpropyl)-, sodium salt",
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    },
    {
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    },
    {
      "@value": "Naphthalenesulfonic acid, diisobutyl-, sodium salt",
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      "@value": [
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}

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