2-{4-[(1S)-1-Hydroxy-4-{4-[Hydroxy(Diphenyl)Methyl]-1-Piperidinyl}Butyl]Phenyl}-2-Methylpropanoic Acid

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Properties Simple | Detailed

Formula C32H39NO4
IUPAC Name 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]-1-piperidyl]butyl]phenyl]-2-methyl-propanoic acid
Molecular Mass 501.656 g·mol−1
Heat of Formation -621.4 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 641.34 Å 3
Surface Area 458.01 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]-1-piperidinyl]butyl]phenyl]-2-methylpropanoic acid
  • 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]-1-piperidyl]butyl]phenyl]-2-methyl-propanoic acid
  • 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]-1-piperidyl]butyl]phenyl]-2-methyl-propionic acid
  • 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methyl-propanoic acid
  • 2-[4-[(1s)-1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid
InChIKey RWTNPBWLLIMQHL-LJAQVGFWSA-N
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