4-[3-(Benzyloxy)-3-Oxopropyl]Phenyl Trans-4-(Aminomethyl)Cyclohexanecarboxylate

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Properties Simple | Detailed

Formula C24H29NO4
IUPAC Name [4-(3-benzyloxy-3-oxo-propyl)phenyl] 4-(aminomethyl)cyclohexanecarboxylate
Molecular Mass 395.491 g·mol−1
Heat of Formation -628.2 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 500.08 Å 3
Surface Area 436.82 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy 0.00 ± eV
Point Group Symmetry C1
InChIKey LPWHBGUXJFSETQ-XUTJKUGGSA-N
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