(4S,5S,6R)-5,6-Dihydroxy-4-Isopropyl-6-Methyl-3,4,5,6,7,8-Hexahydro-1(2H)-Naphthalenone

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Formula C14H22O3
IUPAC Name (4s,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
Molecular Mass 238.323 g·mol−1
Heat of Formation -671.8 ± 16.7 kJ·mol−1
Dipole Moment 1.73 ± 1.08 D
Volume 304.67 Å 3
Surface Area 258.48 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
  • (4s,5s,6r)-5,6-dihydroxy-6-methyl-4-propan-2-yl-2,3,4,5,7,8-hexahydronaphthalen-1-one
InChIKey SZSSWPDHIZIMCT-QCZZGDTMSA-N
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