(1S,3Ar,4S,8Ar)-7-Isopropyl-4-Methoxy-1,4-Dimethyl-1,2,3,3A,4,5,6,8A-Octahydro-1-Azulenol

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Formula C16H28O2
IUPAC Name (1s,3ar,4s,8ar)-7-isopropyl-4-methoxy-1,4-dimethyl-2,3,3a,5,6,8a-hexahydroazulen-1-ol
Molecular Mass 252.392 g·mol−1
Heat of Formation -517.4 ± 16.7 kJ·mol−1
Dipole Moment 2.40 ± 1.08 D
Volume 343.91 Å 3
Surface Area 279.65 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy 1.10 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3ar,4s,8ar)-4-methoxy-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol
  • (1s,3ar,4s,8ar)-7-isopropyl-4-methoxy-1,4-dimethyl-2,3,3a,5,6,8a-hexahydroazulen-1-ol
InChIKey PVUUUQKOVDHRBT-WCVJEAGWSA-N
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