chempirical

Benzoyl disulfide

C14H10O2S2CAS 644-32-6274.35 g/mol

Open in Covalent MOL file
OSSO
Disulfide

Properties

Molecular formula
C14H10O2S2
Molar mass
274.35 g/mol
Exact mass
274.0122 Da
logP
4.05Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Identifiers

CAS number
644-32-6
SMILES
C1=CC=C(C=C1)C(=O)SSC(=O)C2=CC=CC=C2
InChIKey
YYWLHHUMIIIZDH-UHFFFAOYSA-N
InChI
InChI=1S/C14H10O2S2/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H

Weigh it out

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

Names and synonyms

12 names
  • S-Benzoylsulfanyl benzenecarbothioate
  • Dibenzoyl disulfide
  • Dibenzoyl disulphide
  • Disulfide, dibenzoyl
  • Bensulfenum
  • Benthiolan
  • Septiolan
  • Thiocutol
  • Benzoic dithioperoxyanhydride
  • Benzenecarbothioic acid S-(benzoylthio) ester
  • (Benzoyldisulfanyl)(phenyl)methanone
  • Dibenzoyl persulfide

Work with Benzoyl 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

1,4-Dibenzoylbenzene3016-97-548 % similar Benzoyl bromide618-32-646 % similar 1,2-Dibenzoylbenzene1159-86-044 % similar 1,4-Diphenyl-2-butene-1,4-dione4070-75-144 % similar 1,4-Diphenyl-1,4-butanedione495-71-644 % similar Benzoic acid65-85-044 % similar Benzoic anhydride93-97-044 % similar Benzoyl peroxide94-36-044 % similar

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

Elsewhere

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