(9Z,12R)-12-Methyloxacyclododec-9-En-2-One

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Properties Simple | Detailed

Formula C12H20O2
IUPAC Name (9z,12r)-12-methyl-1-oxacyclododec-9-en-2-one
Molecular Mass 196.286 g·mol−1
Heat of Formation -473.4 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 262.78 Å 3
Surface Area 228.45 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy 4.26 ± eV
Point Group Symmetry C1
Synonyms
  • (9z,12r)-12-methyl-1-oxacyclododec-9-en-2-one
  • oxacyclododec-9-en-2-one, 12-methyl-, (r-(e))-
  • recifeiolide
CAS Number(s)
  • 59780-28-8
InChIKey IYNKPPZNZQQWKC-JPVGGKMYSA-N
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