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Ethanamine, 2-(4-(2-bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethyl-, (Z)-

HCID 3036726
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Basic information

CAS
97151-01-4
Standard SMILES
CN(C)CCOc1ccc(/C(=C(\Br)c2ccccc2)c2ccccc2)cc1
InChIKey
IAJYQHATSIOBSH-VHXPQNKSSA-N
Molecular formula
C24H24BrNO
Average molar mass
422.4 g/mol
Monoisotopic mass
421.10413

Names & identifiers

Preferred name
Ethanamine, 2-(4-(2-bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethyl-, (Z)-
IUPAC
2-[4-[(Z)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethylethanamine

Names & synonyms

2-[4-(2-Bromo-1,2-diphenylethenyl)phenoxy]-N,N-dimethyl-ethanamine;(E,Z)-1-Bromo-2-[4-[2-(dimethylamino)ethoxy]phenyl]-1,2-diphenyletheneEthanamine, 2-(4-(2-bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethyl-, (Z)-97151-01-4Ethanamine, 2-[4-(2-bromo-1,2-diphenylethenyl)phenoxy]-N,N-dimethyl-SCHEMBL30353017(Z)-2-(4-(2-Bromo-1,2-diphenylethenyl)phenoxy)-N,N-dimethylethanamine

Database identifiers

CAS
97151-01-4
PubChem CID
3036726
Nikkaji
J947.259B

Properties

Computed structural properties

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

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