(3S,3As,7Ar)-3,6-Dimethyl-2,3,3A,4,5,7A-Hexahydro-1-Benzofuran

Molecule SVG Image

Properties Simple | Detailed

Formula C10H16O
IUPAC Name (3s,3as,7ar)-3,6-dimethyl-2,3,3a,4,5,7a-hexahydrobenzofuran
Molecular Mass 152.233 g·mol−1
Heat of Formation -225.9 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 206.92 Å 3
Surface Area 194.81 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 1.17 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,3as,7ar)-3,6-dimethyl-2,3,3a,4,5,7a-hexahydrobenzofuran
  • anethofuran
  • benzofuran, 2,3,3a,4,5,7a-hexahydro-3,6-dimethyl-, (3s-(3alpha,3aalpha,7aalpha))-
CAS Number(s)
  • 74410-10-9
InChIKey KBPPPUZMFQKLNP-UTLUCORTSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O