G-Caryophyllene

Molecule SVG Image

Properties Simple | Detailed

Formula C15H24
IUPAC Name (1r,4z,9s)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene
Molecular Mass 204.351 g·mol−1
Heat of Formation -34.6 ± 16.7 kJ·mol−1
Dipole Moment 1.33 ± 1.08 D
Volume 297.14 Å 3
Surface Area 250.34 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 1.22 ± eV
Point Group Symmetry C1
Synonyms
  • (−)-isocaryophyllene
  • (1r,4z,9s)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene
  • (1r,4z,9s)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
  • (1r,4z,9s)-4,11,11-trimethyl-8-methylidene-bicyclo[7.2.0]undec-4-ene
  • (1r,4z,9s)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
  • (1r,9s)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene
  • (1r,9s)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
  • (1r,9s)-4,11,11-trimethyl-8-methylidene-bicyclo[7.2.0]undec-4-ene
  • (1r,9s)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
  • (1r,9s)-8-methylen-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene
  • (1r-(1r*,4z,9s*))-4,11,11-trimethyl-8-methylenebicyclo(7.2.0)undec-4-ene
  • bicyclo(7.2.0)undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1r,4z,9s)-
  • isocaryophyllene
  • lmpr01030035
CAS Number(s)
  • 118-65-0
InChIKey NPNUFJAVOOONJE-FLFDDASRSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C