(5Z,7E)-9,10-Secocholesta-5,7,10-Triene

Molecule SVG Image

Properties Simple | Detailed

Formula C27H44
IUPAC Name (1r,3as,4e,7ar)-1-[(1r)-1,5-dimethylhexyl]-7a-methyl-4-[(2z)-2-(2-methylenecyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1h-indene
Molecular Mass 368.638 g·mol−1
Heat of Formation -203.0 ± 16.7 kJ·mol−1
Dipole Moment 0.47 ± 1.08 D
Volume 534.23 Å 3
Surface Area 437.5 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,3as,4e,7ar)-1-[(1r)-1,5-dimethylhexyl]-7a-methyl-4-[(2z)-2-(2-methylenecyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1h-indene
  • (1r,3as,4e,7ar)-7a-methyl-1-[(2r)-6-methylheptan-2-yl]-4-[(2z)-2-(2-methylidenecyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1h-indene
InChIKey FXKMDILIEQILCA-VDVRBEGSSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C