Hernandulcin

Molecule SVG Image

Properties Simple | Detailed

Formula C15H24O2
IUPAC Name (6s)-6-[(1s)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-3-methyl-cyclohex-2-en-1-one
Molecular Mass 236.350 g·mol−1
Heat of Formation -475.3 ± 16.7 kJ·mol−1
Dipole Moment 5.43 ± 1.08 D
Volume 322.61 Å 3
Surface Area 288.16 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 2.78 ± eV
Point Group Symmetry C1
Synonyms
  • (6s)-6-[(1s)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-3-methyl-cyclohex-2-en-1-one
  • (6s)-6-[(1s)-1-hydroxy-1,5-dimethylhex-4-enyl]-3-methyl-1-cyclohex-2-enone
  • (6s)-6-[(2s)-2-hydroxy-6-methyl-hept-5-en-2-yl]-3-methyl-cyclohex-2-en-1-one
  • (6s)-6-[(2s)-2-hydroxy-6-methylhept-5-en-2-yl]-3-methylcyclohex-2-en-1-one
  • (s-(r*,r*))-6-(1-hydroxy-1,5-dimethyl-4-hexenyl)-3-methyl-2-cyclohexen-1-one
  • 2-cyclohexen-1-one, 6-(1-hydroxy-1,5-dimethyl-4-hexenyl)-3-methyl-, (s-(r*,r*))-
CAS Number(s)
  • 95602-94-1
InChIKey HYQNKKAJVPMBDR-HIFRSBDPSA-N
QR Code Generate QR Code
Links PubChem Wikipedia ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O