(2Z)-4-[4-(4-Chlorobenzyl)-1-(Cyclohexylmethyl)-4-Piperidinyl]-2-Hydroxy-4-Oxo-2-Butenoic Acid

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Properties Simple | Detailed

Formula C23H30ClNO4
IUPAC Name (z)-4-[4-[(4-chlorophenyl)methyl]-1-(cyclohexylmethyl)-4-piperidyl]-2-hydroxy-4-oxo-but-2-enoic acid
Molecular Mass 419.942 g·mol−1
Heat of Formation -693.8 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 508.72 Å 3
Surface Area 419.74 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy 1.89 ± eV
Point Group Symmetry C1
Synonyms
  • 2-butenoic acid, 4-[4-[(4-chlorophenyl)methyl]-1-(cyclohexylmethyl)-4-piperidinyl]-2-hydroxy-4-oxo-, (2z)-
InChIKey XWMHHMXKNMXGDP-ZHZULCJRSA-N
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Elements H C N O Cl