Zerumbone

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Properties Simple | Detailed

Formula C15H22O
IUPAC Name (2e,6e,10e)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one
Molecular Mass 218.335 g·mol−1
Heat of Formation -150.5 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 306.67 Å 3
Surface Area 253.5 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,6e,10e)-2,6,9,9-tetramethyl-1-cycloundeca-2,6,10-trienone
  • (2e,6e,10e)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one
  • (e,e,e)-2,6,9,9-tetramethyl-2,6,10-cycloundecatrien-1-one
  • 2,6,10-cycloundecatrien-1-one, 2,6,9,9-tetramethyl-, (e,e,e)-
  • 2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one
CAS Number(s)
  • 471-05-6
InChIKey GIHNTRQPEMKFKO-SKTNYSRSSA-N
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