2-{4-[(1R,2R)-1,2-Diphenylbutyl]Phenoxy}-N,N-Dimethylethanamine

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Properties Simple | Detailed

Formula C26H31NO
IUPAC Name 2-[4-[(1r,2r)-1,2-diphenylbutyl]phenoxy]-n,n-dimethyl-ethanamine
Molecular Mass 373.530 g·mol−1
Heat of Formation 37.7 ± 16.7 kJ·mol−1
Dipole Moment 2.38 ± 1.08 D
Volume 495.16 Å 3
Surface Area 417.26 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 0.26 ± eV
Point Group Symmetry C1
Synonyms
  • (r*,r*)-2-(4-(1,2-diphenylbutyl)phenoxy)-n,n-dimethylethanamine
  • 1-(4-(2-(dimethylamino)ethoxy)phenyl)-1,2-diphenylbutane
  • 2-[4-[(1r,2r)-1,2-di(phenyl)butyl]phenoxy]-n,n-dimethyl-ethanamine
  • 2-[4-[(1r,2r)-1,2-di(phenyl)butyl]phenoxy]-n,n-dimethylethanamine
  • 2-[4-[(1r,2r)-1,2-di(phenyl)butyl]phenoxy]ethyl-dimethyl-amine
  • dihydrotamoxifen
  • ethanamine, 2-(4-(1,2-diphenylbutyl)phenoxy)-n,n-dimethyl-, (r*,r*)-
CAS Number(s)
  • 109640-20-2
InChIKey YUFAHBUWIVNVNJ-IZZNHLLZSA-N
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