(1R,2R,4S,6R)-2,7,7-Trimethyl-3-Oxatricyclo[4.1.1.0~2,4~]Octane

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Properties Simple | Detailed

Formula C10H16O
IUPAC Name (1r,2r,4s,6r)-2,7,7-trimethyl-3-oxatricyclo[4.1.1.0 2,4 ]octane
Molecular Mass 152.233 g·mol−1
Heat of Formation -75.4 ± 16.7 kJ·mol−1
Dipole Moment 2.30 ± 1.08 D
Volume 205.31 Å 3
Surface Area 186.61 Å 2
HOMO Energy -10.06 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
Synonyms
  • (1r-(1alpha,2beta,4beta,6alpha))-2,2,7-trimethyl-3-oxatricyclo(4.1.1.02,4)octane
CAS Number(s)
  • 19894-99-6
InChIKey NQFUSWIGRKFAHK-BDNRQGISSA-N
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Elements H C O