(E)-4-(3-Bromo-1-(4-nitrophenyl)-1-propenyl)-4'-chloro-1,1'-biphenyl
Basic information
- CAS
94732-95-3- Standard SMILES
O=[N+]([O-])c1ccc(/C(=C/CBr)c2ccc(-c3ccc(Cl)cc3)cc2)cc1- InChIKey
GQBFSMFIHUYXCM-FYJGNVAPSA-N- Molecular formula
- C21H15BrClNO2
- Average molar mass
- 428.7 g/mol
- Monoisotopic mass
- 426.99747
Names & identifiers
- Preferred name
- (E)-4-(3-Bromo-1-(4-nitrophenyl)-1-propenyl)-4'-chloro-1,1'-biphenyl
- IUPAC
- 1-[(E)-3-bromo-1-(4-nitrophenyl)prop-1-enyl]-4-(4-chlorophenyl)benzene
- English name
- (E)-4-[3-bromo-1-(4-nitrophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl
- Molecular formula
- C21H15BrClNO2
- Molecular weight
- 428.7063
Names & synonyms
94732-95-3EINECS 305-578-0(E)-4-(3-Bromo-1-(4-nitrophenyl)-1-propenyl)-4'-chloro-1,1'-biphenylGQBFSMFIHUYXCM-FYJGNVAPSA-NDTXSID9011499474-[(1E)-3-bromo-1-(4-nitrophenyl)prop-1-en-1-yl]-4'-chloro-1,1'-biphenylNS000661901,1a(2)-Biphenyl, 4-[3-bromo-1-(4-nitrophenyl)-1-propenyl]-4a(2)-chloro-, (E)-4-[(E)-3-Bromo-1-(4-nitrophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl(E)-4-[3-bromo-1-(4-nitrophenyl)-1-propenyl]-4'-chloro-1,1'-biphenyl1-[(E)-3-bromo-1-(4-nitrophenyl)prop-1-enyl]-4-(4-chlorophenyl)benzene
Database identifiers
- CAS
94732-95-3- PubChem CID
- 6366556
- DTXSID
DTXSID901149947- EC Number
- 305-578-0
- Nikkaji
- J326.297I
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 483
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