Basic information
- CAS
51072-30-1- Standard SMILES
O=S(=O)(SS(=O)(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1- InChIKey
IHHNCOFRZJJNIH-UHFFFAOYSA-N- Molecular formula
- C12H8Cl2O4S3
- Average molar mass
- 383.3 g/mol
- Monoisotopic mass
- 381.8961776
Names & identifiers
- Preferred name
- 1-Chloro-4-(4-chlorophenyl)sulfonylsulfanylsulfonyl-benzene
- IUPAC
- 1-chloro-4-(4-chlorophenyl)sulfonylsulfanylsulfonylbenzene
Names & synonyms
51072-30-11-chloro-4-(4-chlorophenyl)sulfonylsulfanylsulfonyl-benzeneNSC 85741NSC85741NSC-857411-chloro-4-(4-chlorophenyl)sulfonylsulfanylsulfonylbenzeneNCIOpen2_009566QA3X75KN7QDTXSID90199078Benzenesulfonothioic acid, 4-chloro-, anhydrosulfide
Database identifiers
- CAS
51072-30-1- PubChem CID
- 257590
- DTXSID
DTXSID90199078- UNII
- QA3X75KN7Q
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 484
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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