4-[(1S,2R)-2-(4-Benzyl-1-Piperidinyl)-1-Hydroxypropyl]Phenol

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Properties Simple | Detailed

Formula C21H27NO2
IUPAC Name 4-[(1s,2r)-2-(4-benzyl-1-piperidyl)-1-hydroxy-propyl]phenol
Molecular Mass 325.445 g·mol−1
Heat of Formation -261.4 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 423.58 Å 3
Surface Area 361.73 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 0.17 ± eV
Point Group Symmetry C1
InChIKey UYNVMODNBIQBMV-IIBYNOLFSA-N
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