Basic information
- CAS
60640-57-5- Standard SMILES
CSc1cc(Cl)c(-c2cc(Cl)ccc2Cl)cc1Cl- InChIKey
LUZWJARHZJMSDU-UHFFFAOYSA-N- Molecular formula
- C13H8Cl4S
- Average molar mass
- 338.1 g/mol
- Monoisotopic mass
- 335.910082
Overview
structure given in first source
Names & identifiers
- Preferred name
- 2,5,2',5'-Tetrachloro-4-methylthiobiphenyl
- IUPAC
- 1,4-dichloro-2-(2,5-dichlorophenyl)-5-methylsulfanylbenzene
- English name
- 2,5,2',5'-tetrachloro-4-methylthiobiphenyl
- Molecular formula
- C13H8Cl4S
- Molecular weight
- 338.08
Names & synonyms
2,5,2',5'-Tetrachloro-4-methylthiobiphenyl60640-57-5DTXSID00209450RefChem:82654DTXCID201319411,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylthio)-DB-3235062,2',5,5'-Tetrachloro-4-(methylsulfanyl)-1,1'-biphenyl
Database identifiers
- CAS
60640-57-5- PubChem CID
- 173752
- DTXSID
DTXSID00209450
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…