Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Butanedioic acid, 2-sulfo-, 1,4-bis(2,6-dimethylheptyl) ester, sodium salt (1:1)
RN: 63217-13-0
InChIKey: VKDIBUUSCYWJOQ-UHFFFAOYSA-M

Molecular Formula

  • C22-H42-O7-S.Na

Molecular Weight

  • 472.615
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 264-016-1

Systematic Names

  • Butanedioic acid, 2-sulfo-, 1,4-bis(2,6-dimethylheptyl) ester, sodium salt (1:1)
  • Butanedioic acid, sulfo-, 1,4-bis(2,6-dimethylheptyl) ester, sodium salt
  • Sodium 1,4-bis(2,6-dimethylheptyl) sulphonatosuccinate

Registry Numbers

CAS Registry Number

  • 63217-13-0

System Generated Number

  • 0063217130

Molecular Formulas

Molecular Formula

  • C22-H42-O7-S.Na

Molecular Formula Fragments

  • C22-H42-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C22H42O7S.Na/c1-16(2)9-7-11-18(5)14-28-21(23)13-20(30(25,26)27)22(24)29-15-19(6)12-8-10-17(3)4;/h16-20H,7-15H2,1-6H3,(H,25,26,27);/q;+1/p-1

InChIKey

VKDIBUUSCYWJOQ-UHFFFAOYSA-M

Smiles

[Na+].C(OC(C[C@@H](C(OC[C@@H](CCCC(C)C)C)=O)S(=O)(=O)[O-])=O)[C@@H](C)CCCC(C)C