2,2',3',4-Tetrachloro-5-(methylsulfonyl)-1,1'-biphenyl
Basic information
- CAS
104086-03-5- Standard SMILES
CS(=O)(=O)c1cc(-c2cccc(Cl)c2Cl)c(Cl)cc1Cl- InChIKey
FAQONLJXYMUULU-UHFFFAOYSA-N- Molecular formula
- C13H8Cl4O2S
- Average molar mass
- 370.1 g/mol
- Monoisotopic mass
- 367.899911
Names & identifiers
- Preferred name
- 2,2',3',4-Tetrachloro-5-(methylsulfonyl)-1,1'-biphenyl
- IUPAC
- 1,5-dichloro-2-(2,3-dichlorophenyl)-4-methylsulfonylbenzene
Names & synonyms
104086-03-51,1'-Biphenyl, 2,2',3',4-tetrachloro-5-(methylsulfonyl)-2,2',3',4-Tetrachloro-5-(methylsulfonyl)-1,1'-biphenylDTXSID001462552,2',3,4'-Tetrachloro-5'-(methanesulfonyl)-1,1'-biphenyl
Database identifiers
- CAS
104086-03-5- PubChem CID
- 190692
- DTXSID
DTXSID00146255
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 436
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Compound notes
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