2-{4-[(1E)-1-(4-Chlorophenyl)-2-Phenyl-1-Buten-1-Yl]Phenoxy}-N,N-Dimethylethanamine

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Properties Simple | Detailed

Formula C26H28ClNO
IUPAC Name 2-[4-[(e)-1-(4-chlorophenyl)-2-phenyl-but-1-enyl]phenoxy]-n,n-dimethyl-ethanamine
Molecular Mass 405.960 g·mol−1
Heat of Formation 71.0 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 506.06 Å 3
Surface Area 432.55 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[(e)-1-(4-chlorophenyl)-2-phenyl-but-1-enyl]phenoxy]-n,n-dimethyl-ethanamine
  • 2-[4-[(e)-1-(4-chlorophenyl)-2-phenyl-but-1-enyl]phenoxy]ethyl-dimethyl-amine
  • 2-[4-[(e)-1-(4-chlorophenyl)-2-phenylbut-1-enyl]phenoxy]-n,n-dimethylethanamine
  • 4-chlorotamoxifen
  • ethanamine, 2-(4-(1-(4-chlorophenyl)-2-phenyl-1-butenyl)phenoxy)-n,n-dimethyl-, (e)-
  • para-chlorotamoxifen
CAS Number(s)
  • 77588-46-6
InChIKey HKUVASGVWSXQDV-QPLCGJKRSA-N
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Elements H C N O Cl