B-Cyclocitral

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Properties Simple | Detailed

Formula C10H16O
IUPAC Name 2,6,6-trimethylcyclohexene-1-carbaldehyde
Molecular Mass 152.233 g·mol−1
Heat of Formation -225.7 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 210.56 Å 3
Surface Area 194.08 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 0.45 ± eV
Point Group Symmetry C1
Synonyms
  • .beta.-cyclocitral
  • 1-cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl-
  • 2,6,6-trimethyl-1-cyclohexen-1-carboxaldehyde
  • 2,6,6-trimethyl-1-cyclohexene-1-carboxaldehyde
  • 2,6,6-trimethyl-1-cyclohexenecarboxaldehyde
  • 2,6,6-trimethylcyclohex-1-ene-1-carbaldehyde
  • 2,6,6-trimethylcyclohexenecarbaldehyde
  • alpha(beta)-cyclocitral
  • beta-cyclocitral
  • cyclohexenecarboxaldehyde, 2,6,6-trimethyl-
CAS Number(s)
  • 52844-21-0
  • 432-25-7
InChIKey MOQGCGNUWBPGTQ-UHFFFAOYSA-N
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