(4Z,6R,7S,8S,9E)-7-Hydroxy-8-Methoxy-4,6-Dimethyl-4,9-Cyclotetradecadien-1-One

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Properties Simple | Detailed

Formula C17H28O3
IUPAC Name (4z,6r,7s,8s,9e)-7-hydroxy-8-methoxy-4,6-dimethyl-cyclotetradeca-4,9-dien-1-one
Molecular Mass 280.402 g·mol−1
Heat of Formation -615.2 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 381.07 Å 3
Surface Area 311.84 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 3.75 ± eV
Point Group Symmetry C1
Synonyms
  • (4z,6r,7s,8s,9e)-7-hydroxy-8-methoxy-4,6-dimethyl-1-cyclotetradeca-4,9-dienone
  • (4z,6r,7s,8s,9e)-7-hydroxy-8-methoxy-4,6-dimethyl-cyclotetradeca-4,9-dien-1-one
  • (4z,6r,7s,8s,9e)-7-hydroxy-8-methoxy-4,6-dimethylcyclotetradeca-4,9-dien-1-one
InChIKey GNVGUUJMZICZND-YFFRELIDSA-N
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