3,5-Dibromo-4-methoxy-biphenyl
Basic information
- CAS
860585-38-2- Standard SMILES
COc1c(Br)cc(-c2ccccc2)cc1Br- InChIKey
ADHLXWXIHZFYMC-UHFFFAOYSA-N- Molecular formula
- C13H10Br2O
- Average molar mass
- 342.02 g/mol
- Monoisotopic mass
- 339.90984
Names & identifiers
- Preferred name
- 3,5-Dibromo-4-methoxy-biphenyl
- IUPAC
- 1,3-dibromo-2-methoxy-5-phenylbenzene
- English name
- 3,5-Dibromo-4-methoxy-1,1'-biphenyl
- Molecular formula
- C13H10Br2O
- Molecular weight
- 342.03
Names & synonyms
AKOS0243258323,5-DIBROMO-4-METHOXY-BIPHENYL3,5-Dibromo-4-methoxy-1,1'-biphenyl
Database identifiers
- CAS
860585-38-2- PubChem CID
- 3589110
- EC Number
- 150-453-4
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- Melting point
- 87 °C · 87 °C
- Boiling point
- 361.9 · 361.9±42.0 °C(predicted)
- Density
- 1.62 · 1.620±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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