chempirical

Dibenzyl disulfide

C14H14S2CAS 150-60-7246.39 g/mol

Open in Covalent MOL file
SS
Disulfide

Properties

Molecular formula
C14H14S2
Molar mass
246.39 g/mol
Exact mass
246.0537 Da
Density
1.085 g/mL (at 100.2 °C)
Melting point
71.5 °C
Boiling point
142–148 °C (at NaN Torr)
logP
4.77Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
5

Identifiers

CAS number
150-60-7
SMILES
c1ccc(CSSCc2ccccc2)cc1
InChIKey
GVPWHKZIJBODOX-UHFFFAOYSA-N
InChI
InChI=1S/C14H14S2/c1-3-7-13(8-4-1)11-15-16-12-14-9-5-2-6-10-14/h1-10H,11-12H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

16 names · show all
  • Disulfide, bis(phenylmethyl)
  • Benzyl disulfide
  • Bis(phenylmethyl) disulfide
  • Benzyl bisulfide
  • α-(Benzyldithio)toluene
  • Di(phenylmethyl)disulfide
  • 1,4-Diphenyl-2,3-dithiabutane
  • BDS
  • Dibenzyl disulphide
  • Dailube S 700
  • S 700
  • NSC 677465
  • NSC 6841
  • T 322
  • 1,2-Dibenzyldisulfane
  • (Benzyldisulfanyl)methylbenzene

Work with Dibenzyl disulfide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dibenzyl sulfide538-74-967 % similar Benzyl methyl disulfide699-10-567 % similar Benzyl methyl sulfide766-92-757 % similar Benzyl phenyl sulfide831-91-457 % similar Bibenzyl103-29-753 % similar Tropeolin3012-37-152 % similar Diphenylmethane101-81-550 % similar 1,3-Diphenylpropane1081-75-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

P-Tolyl disulfide103-19-5 1,2-Bis(phenylthio)ethane622-20-8

Elsewhere

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