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Substance Name: 1-Propanesulfinothioic acid, S-propyl ester
RN: 1948-52-3
InChIKey: XPRZAEWSYWTDSQ-UHFFFAOYSA-N

Molecular Formula

  • C6-H14-O-S2

Molecular Weight

  • 166.308
 
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Names and Synonyms

Synonyms

  • 1-Propanesulfinothioic acid, S-propyl ester
  • EINECS 217-755-9
  • NSC 23131

Systematic Names

  • 1-Propanesulfinothioic acid, S-propyl ester
  • S-Propyl propane-1-thiosulphinate

Registry Numbers

CAS Registry Number

  • 1948-52-3

Other Registry Number

  • 85085-09-2

System Generated Number

  • 0001948523

Structure Descriptors

InChI

1S/C6H14OS2/c1-3-5-8-9(7)6-4-2/h3-6H2,1-2H3

InChIKey

XPRZAEWSYWTDSQ-UHFFFAOYSA-N

Smiles

O=[S@@](SCCC)CCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.140 (none)   EST
Water Solubility 2.00E+04 mg/L   EXP
Atmospheric OH Rate Constant 2.46E-10 cm3/molecule-sec 25 EST

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