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Substance Name: 12-Sulphoricinic acid
RN: 36634-48-7
UNII: 85TV682Y9O
InChIKey: CYKFQSXTIVGYDT-QJWNTBNXSA-N

Molecular Formula

  • C18-H34-O6-S

Molecular Weight

  • 378.5266
 
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Names and Synonyms

Name of Substance

  • 12-Sulphoricinic acid

Synonyms

  • 12-Sulphoricinic acid
  • 12O-Sulforicinoleic acid
  • 9-Octadecenoic acid, 12-(sulfooxy)-, (9Z,12R)-
  • Ricinoleic acid sulfate [MI]
  • UNII-85TV682Y9O

Registry Numbers

CAS Registry Number

  • 36634-48-7

FDA UNII

  • 85TV682Y9O

System Generated Number

  • 0036634487

Structure Descriptors

InChI

1S/C18H34O6S/c1-2-3-4-11-14-17(24-25(21,22)23)15-12-9-7-5-6-8-10-13-16-18(19)20/h9,12,17H,2-8,10-11,13-16H2,1H3,(H,19,20)(H,21,22,23)/b12-9-/t17-/m1/s1

InChIKey

CYKFQSXTIVGYDT-QJWNTBNXSA-N

Smiles

CCCCCC[C@H](C/C=C\CCCCCCCC(=O)O)OS(=O)(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.840 (none)   EST
Water Solubility 1.00E+05 mg/L   EXP
Atmospheric OH Rate Constant 7.63E-11 cm3/molecule-sec 25 EST

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