(2S,3S)-2-(Diphenylmethyl)-N-(2-Methoxybenzyl)Quinuclidin-3-Amine

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Properties Simple | Detailed

Formula C28H32N2O
IUPAC Name (2s,3s)-2-benzhydryl-n-[(2-methoxyphenyl)methyl]quinuclidin-3-amine
Molecular Mass 412.566 g·mol−1
Heat of Formation 138.5 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 528.79 Å 3
Surface Area 408.98 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-2-[di(phenyl)methyl]-n-[(2-methoxyphenyl)methyl]-3-quinuclidinamine
  • (2s,3s)-2-[di(phenyl)methyl]-n-[(2-methoxyphenyl)methyl]quinuclidin-3-amine
  • (2s,3s)-cis-2-(diphenylmethyl)-n-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
  • (7s,8s)-7-[di(phenyl)methyl]-n-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-8-amine
  • 1-azabicyclo(2.2.2)octan-3-amine, 2-(diphenylmethyl)-n-((2-methoxyphenyl)methyl)-, (2s-cis)-
  • 2-(diphenylmethyl)-n-((2-methoxyphenyl)methyl)-1-azabicyclo(2.2.2)octan-3-amine
  • [(2s,3s)-2-[di(phenyl)methyl]quinuclidin-3-yl]-(2-methoxybenzyl)amine
  • cp 96,345
  • cp 96345
  • cp-96,345
  • cp-96345
CAS Number(s)
  • 132746-60-2
InChIKey FLNYLINBEZROPL-NSOVKSMOSA-N
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