(1R,5R)-5-(2-Methyl-2-Propanyl)-2-Phenyl-2-Cyclohexen-1-Ol

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Properties Simple | Detailed

Formula C16H22O
IUPAC Name (1r,5r)-5-tert-butyl-2-phenyl-cyclohex-2-en-1-ol
Molecular Mass 230.345 g·mol−1
Heat of Formation -185.2 ± 16.7 kJ·mol−1
Dipole Moment 1.73 ± 1.08 D
Volume 311.91 Å 3
Surface Area 272.34 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,5r)-5-tert-butyl-2-phenyl-1-cyclohex-2-enol
  • (1r,5r)-5-tert-butyl-2-phenyl-cyclohex-2-en-1-ol
  • (1r,5r)-5-tert-butyl-2-phenylcyclohex-2-en-1-ol
CAS Number(s)
  • 69257-77-8
InChIKey CVQFQMQNPZDLFL-UKRRQHHQSA-N
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Elements H C O