Basic information
- CAS
153310-27-1- Standard SMILES
CS(=O)(=O)c1cc(Cl)c(Cl)c(-c2cc(Cl)c(Cl)c(Cl)c2Cl)c1Cl- InChIKey
FMSIXFJPPLDDRH-UHFFFAOYSA-N- Molecular formula
- C13H5Cl7O2S
- Average molar mass
- 473.4 g/mol
- Monoisotopic mass
- 469.782994
Names & identifiers
- Preferred name
- 2,2',3',4',5,5',6-Heptachloro-3-methylsulfonylbiphenyl
- IUPAC
- 1,2,3,4-tetrachloro-5-(2,3,6-trichloro-5-methylsulfonylphenyl)benzene
Names & synonyms
153310-27-13'-Methylsulfonyl-PCB 1743-Methylsulfonyl-2,2',3',4',5,5',6-heptachlorobiphenyl1,1'-Biphenyl, 2,2',3,3',4,5,6'-heptachloro-3'-(methylsulfonyl)-2,2',3',4',5,5',6-Heptachloro-3-methylsulfonylbiphenylDTXSID90934724FMSIXFJPPLDDRH-UHFFFAOYSA-N2,2',3',4',5,5',6-Heptachloro[1,1'-biphenyl]-3-yl methyl sulfone #2,2',3,3',4,5,6'-Heptachloro-5'-(methanesulfonyl)-1,1'-biphenyl
Database identifiers
- CAS
153310-27-1- PubChem CID
- 635382
- DTXSID
DTXSID90934724- Nikkaji
- J952.363D
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 525
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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