(5S)-5-Hydroxy-1-(4-Hydroxy-3-Methoxyphenyl)-3-Dodecanone

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Properties Simple | Detailed

Formula C19H30O4
IUPAC Name (5s)-5-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)dodecan-3-one
Molecular Mass 322.439 g·mol−1
Heat of Formation -826.6 ± 16.7 kJ·mol−1
Dipole Moment 4.20 ± 1.08 D
Volume 428.56 Å 3
Surface Area 399.41 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (5s)-5-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)dodecan-3-one
  • (5s)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)dodecan-3-one
  • (8)-gingerol
  • (s)-(+)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-dodecanone
  • 3-dodecanone, 5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-, (s)-(+)-
CAS Number(s)
  • 23513-08-8
InChIKey BCIWKKMTBRYQJU-INIZCTEOSA-N
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