3-[(1E)-1-{4-[2-(Methylamino)Ethoxy]Phenyl}-2-Phenyl-1-Buten-1-Yl]Phenol

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Properties Simple | Detailed

Formula C25H27NO2
IUPAC Name 3-[(e)-1-[4-[2-(methylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol
Molecular Mass 373.487 g·mol−1
Heat of Formation -79.5 ± 16.7 kJ·mol−1
Dipole Moment 2.17 ± 1.08 D
Volume 480.08 Å 3
Surface Area 406.18 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 2.99 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(e)-1-[4-(2-methylaminoethoxy)phenyl]-2-phenyl-but-1-enyl]phenol
  • 3-[(e)-1-[4-(2-methylaminoethoxy)phenyl]-2-phenylbut-1-enyl]phenol
  • n-demethyl-3-hydroxytamoxifen
  • n-demethyldroloxifene
  • phenol, 3-(1-(4-(2-(methylamino)ethoxy)phenyl)-2-phenyl-1-butenyl)-, (e)-
CAS Number(s)
  • 83647-33-0
InChIKey QPHNKIXIKDPNDI-OCOZRVBESA-N
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