(E)-4-(3-Bromo-1-(4-chlorophenyl)-1-propenyl)-4'-chloro-1,1'-biphenyl
Basic information
- CAS
94732-96-4- Standard SMILES
Clc1ccc(/C(=C/CBr)c2ccc(-c3ccc(Cl)cc3)cc2)cc1- InChIKey
UHMITVQUNZOQJG-FYJGNVAPSA-N- Molecular formula
- C21H15BrCl2
- Average molar mass
- 418.1 g/mol
- Monoisotopic mass
- 415.97342
Names & identifiers
- Preferred name
- (E)-4-(3-Bromo-1-(4-chlorophenyl)-1-propenyl)-4'-chloro-1,1'-biphenyl
- IUPAC
- 1-[(E)-3-bromo-1-[4-(4-chlorophenyl)phenyl]prop-1-enyl]-4-chlorobenzene
- English name
- (E)-4-[3-bromo-1-(4-chlorophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl
- Molecular formula
- C21H15BrCl2
- Molecular weight
- 418.15
Names & synonyms
94732-96-4EINECS 305-579-6(E)-4-(3-Bromo-1-(4-chlorophenyl)-1-propenyl)-4'-chloro-1,1'-biphenylUHMITVQUNZOQJG-FYJGNVAPSA-NDTXSID9011481254-[(1E)-3-bromo-1-(4-chlorophenyl)prop-1-en-1-yl]-4'-chloro-1,1'-biphenylNS000931211,1a(2)-Biphenyl, 4-[3-bromo-1-(4-chlorophenyl)-1-propenyl]-4a(2)-chloro-, (E)-4-[(E)-3-Bromo-1-(4-chlorophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl(E)-4-[3-bromo-1-(4-chlorophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl1-[(E)-3-bromo-1-[4-(4-chlorophenyl)phenyl]prop-1-enyl]-4-chlorobenzene1,1'-Biphenyl, 4-[3-bromo-1-(4-chlorophenyl)-1-propenyl]-4'-chloro-, (E)- (9CI)
Database identifiers
- CAS
94732-96-4- PubChem CID
- 6366555
- DTXSID
DTXSID901148125- EC Number
- 305-579-6
- Nikkaji
- J326.298G
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- Boiling point
- 496.9 · 496.9±33.0 °C(Predicted)
- Density
- 1.397 · 1.397±0.06 g/cm3(Predicted)
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Compound notes
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