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Substance Name: Sodium tetradecylbenzenesulfonate
RN: 28348-61-0
UNII: X3RJR53V48
InChIKey: GWCMKOHVMSHWKI-UHFFFAOYSA-M

Molecular Formula

  • C20-H34-O3-S.Na

Molecular Weight

  • 376.534
 
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Names and Synonyms

Name of Substance

  • Sodium tetradecylbenzenesulfonate

Synonyms

  • EINECS 248-985-8
  • Sodium tetradecylbenzenesulfonate
  • UNII-X3RJR53V48

Systematic Names

  • Benzenesulfonic acid, tetradecyl-, sodium salt
  • Benzenesulfonic acid, tetradecyl-, sodium salt (1:1)
  • Sodium tetradecylbenzenesulphonate

Registry Numbers

CAS Registry Number

  • 28348-61-0

FDA UNII

  • X3RJR53V48

Other Registry Number

  • 139878-55-0

System Generated Number

  • 0028348610

Molecular Formulas

Molecular Formula

  • C20-H34-O3-S.Na

Molecular Formula Fragments

  • C20-H34-O3-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H34O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-15-17-20(18-16-19)24(21,22)23;/h15-18H,2-14H2,1H3,(H,21,22,23);/q;+1/p-1

InChIKey

GWCMKOHVMSHWKI-UHFFFAOYSA-M

Smiles

c1(ccc(S(=O)(=O)[O-])cc1)CCCCCCCCCCCCCC.[Na+]

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.980 (none)   EST
Water Solubility 1.710 mg/L 25 EST
Vapor Pressure 4.03E-16 mm Hg 25 EST
Atmospheric OH Rate Constant 1.90E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.