Basic information
- CAS
60082-97-5- Standard SMILES
COc1cc(Cl)cc(-c2cc(Cl)c(Cl)cc2Cl)c1Cl- InChIKey
YEVLZBGKWIOXOL-UHFFFAOYSA-N- Molecular formula
- C13H7Cl5O
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 353.893953
Names & identifiers
- Preferred name
- 2,2',4',5,5'-Pentachloro-3-methoxy-1,1'-biphenyl
- IUPAC
- 1,2,4-trichloro-5-(2,5-dichloro-3-methoxyphenyl)benzene
Names & synonyms
60082-97-5DTXSID006214912,2',4',5,5'-Pentachloro-3-methoxy-1,1'-biphenylRefChem:241970DTXCID30572245SCHEMBL7905156
Database identifiers
- CAS
60082-97-5- PubChem CID
- 22013532
- DTXSID
DTXSID00621491
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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