Bis(3,5-dichlorophenyl) disulfide

C12H6Cl4S2CAS 137897-99-5356.10 g/mol

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ClClSSClCl
Aryl halideDisulfide

Properties

Molecular formula
C12H6Cl4S2
Molar mass
356.10 g/mol
Exact mass
353.8665 Da
logP
7.10Crippen estimate
Polar surface area
0.0 Ų
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.

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Identifiers

CAS number
137897-99-5
SMILES
C1=C(C=C(C=C1Cl)Cl)SSC2=CC(=CC(=C2)Cl)Cl
InChIKey
JMQANWHMOHXBEA-UHFFFAOYSA-N
InChI
InChI=1S/C12H6Cl4S2/c13-7-1-8(14)4-11(3-7)17-18-12-5-9(15)2-10(16)6-12/h1-6H

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Names and synonyms

1 names
  • 3,3',5,5'-Tetrachlorodiphenyl disulfide

Work with Bis(3,5-dichlorophenyl) 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

1,3,5-Trichlorobenzene108-70-360 % similar 3,3'-Dichloro diphenyl disulfide19742-92-857 % similar 3,5-Dichlorothioanisole68121-46-057 % similar Bis(p-chlorophenyl)disulfide1142-19-450 % similar 3,5-Dichlorophenyl thioethanol101079-86-146 % similar 1,3-Dichloro-5-fluorobenzene1435-46-743 % similar 3,5-Dichlorobenzenethiol17231-94-643 % similar Bromo-3,5-dichlorobenzene19752-55-743 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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