1-[(3R,4S)-4-(1-Cyclohexen-1-Yl)-2,2,5,5-Tetramethyl-3-Hexanyl]Cyclohexene

Molecule SVG Image

Properties Simple | Detailed

Formula C22H38
IUPAC Name 1-[(1s,2r)-1-tert-butyl-2-(cyclohexen-1-yl)-3,3-dimethyl-butyl]cyclohexene
Molecular Mass 302.537 g·mol−1
Heat of Formation -225.7 ± 16.7 kJ·mol−1
Dipole Moment 0.69 ± 1.08 D
Volume 432.79 Å 3
Surface Area 326.11 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(1s,2r)-1-tert-butyl-2-(1-cyclohexenyl)-3,3-dimethyl-butyl]cyclohexene
  • 1-[(1s,2r)-1-tert-butyl-2-(1-cyclohexenyl)-3,3-dimethylbutyl]cyclohexene
  • 1-[(3s,4r)-4-(1-cyclohexenyl)-2,2,5,5-tetramethyl-hexan-3-yl]cyclohexene
  • 1-[(3s,4r)-4-(1-cyclohexenyl)-2,2,5,5-tetramethylhexan-3-yl]cyclohexene
InChIKey XIRWMTOAKDZMDH-BGYRXZFFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C