3,3'-Dichloro diphenyl disulfide

C₁₂H₈Cl₂S₂CAS 19742-92-8287.22 g/mol

Open in Covalent MOL file

Aryl halide Disulfide

Properties

Molecular formula: C₁₂H₈Cl₂S₂
Molar mass: 287.22 g/mol
Exact mass: 285.9444 Da
logP: 5.79Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

19742-92-8

SMILES

C1=CC(=CC(=C1)Cl)SSC2=CC(=CC=C2)Cl

InChIKey

OLOYVIPZMIIGOH-UHFFFAOYSA-N

InChI

InChI=1S/C12H8Cl2S2/c13-9-3-1-5-11(7-9)15-16-12-6-2-4-10(14)8-12/h1-8H

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Work with 3,3'-Dichloro diphenyl 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-Chloro-3-(methylthio)benzene4867-37-263 % similar 1,3-Dichlorobenzene541-73-158 % similar Bis(3,5-dichlorophenyl) disulfide137897-99-557 % similar 3-Chlorotoluene108-41-850 % similar Bis(3-fluorophenyl)disulfide63930-17-650 % similar 3-[(3-Hydroxyphenyl)disulfanyl]phenol21101-56-448 % similar 1-Chloro-3-fluorobenzene625-98-946 % similar 1-Bromo-3-chlorobenzene108-37-244 % similar

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

Same formula

Bis(p-chlorophenyl)disulfide1142-19-4

Elsewhere

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