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Substance Name: Benzyl phenyl sulphide
RN: 831-91-4
InChIKey: LKMCJXXOBRCATQ-UHFFFAOYSA-N

Molecular Formula

  • C13-H12-S

Molecular Weight

  • 200.304
 
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Names and Synonyms

Synonyms

  • Benzyl phenyl sulfide
  • EINECS 212-612-7
  • NSC 56472
  • Phenyl benzyl sulfide

Systematic Names

  • Benzene, ((phenylmethyl)thio)- (9CI)
  • Benzyl phenyl sulphide
  • Sulfide, benzyl phenyl (8CI)

Registry Numbers

CAS Registry Number

  • 831-91-4

System Generated Number

  • 0000831914

Structure Descriptors

InChI

1S/C13H12S/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-10H,11H2

InChIKey

LKMCJXXOBRCATQ-UHFFFAOYSA-N

Smiles

c1(CSc2ccccc2)ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 43.5 deg C   EXP
log P (octanol-water) 4.300 (none)   EST
Atmospheric OH Rate Constant 2.47E-11 cm3/molecule-sec 25 EST

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