trans-(E)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenylethene
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Basic information
- CAS
19118-19-5- Standard SMILES
CN(C)CCOc1ccc(/C(=C(/Br)c2ccccc2)c2ccccc2)cc1- InChIKey
IAJYQHATSIOBSH-WCWDXBQESA-N- Molecular formula
- C24H24BrNO
- Average molar mass
- 422.4 g/mol
- Monoisotopic mass
- 421.10413
Names & identifiers
- Preferred name
- trans-(E)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenylethene
- IUPAC
- 2-[4-[(E)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethylethanamine
- English name
- (E,Z)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenylethene
- Molecular formula
- C24H24BrNO
- Molecular weight
- 422.36
Names & synonyms
19118-19-5TRANS-(E)-1-BROMO-2-[4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL]-1,2-DIPHENYLETHENE2-[4-[(E)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethylethanamine(E,Z)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenyletheneEthanamine, 2-[4-[(1E)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethyl-(E)-2-(4-(2-Bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethylethanamineEthanamine, 2-(4-(2-bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethyl-, (E)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenylethene2-[4-[(E)-2-Bromo-1,2-diphenylvinyl]phenoxy]-N,N-dimethylethanamine2-[4-[(1E)-2-BroMo-1,2-diphenylethenyl]phenoxy]-N,N-diMethyl-ethanaMine
Database identifiers
- CAS
19118-19-5- PubChem CID
- 3036712
- Nikkaji
- J947.258D
Properties
Computed structural propertiesFilling in
- XLogP
- 6.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 455
Physicochemical properties
- Melting point
- 105 · 105-107°C
- solubility
- soluble in Dichloromethane, Ethyl Acetate, Methanol
- form
- Solid
- color
- White
- CAS DataBase Reference
- 19118 · 19118-19-5
Chemistry & industry
Applications
UsesAn analogue of tamoxifen with anti-estrogenic properties
Related reactions
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Compound notes
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