4,4'-Diiodo-2,2',5,5'-tetrachlorobiphenyl
Basic information
- CAS
36649-77-1- Standard SMILES
Clc1cc(-c2cc(Cl)c(I)cc2Cl)c(Cl)cc1I- InChIKey
PZUXVIRGHJFYQS-UHFFFAOYSA-N- Molecular formula
- C12H4Cl4I2
- Average molar mass
- 543.8 g/mol
- Monoisotopic mass
- 541.71566
Names & identifiers
- Preferred name
- 4,4'-Diiodo-2,2',5,5'-tetrachlorobiphenyl
- IUPAC
- 1,4-dichloro-2-(2,5-dichloro-4-iodophenyl)-5-iodobenzene
Names & synonyms
36649-77-12,2',5,5'-Tetrachloro-4,4'-diiodo-1,1'-biphenyl1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4,4'-diiodo-4,4'-Diiodo-2,2',5,5'-tetrachlorobiphenyl2,2',5,5'-Tetrachloro-4,4'-diiodobiphenylDTXSID10190108
Database identifiers
- CAS
36649-77-1- PubChem CID
- 135019
- DTXSID
DTXSID10190108
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 263
Related reactions
Related reactions could not be loaded. Please try again later.
Compound notes
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