(4R,4As,8As)-4-[2-(3-Furyl)Ethyl]-4-Hydroxy-3,4A,8,8-Tetramethyl-4A,5,6,7,8,8A-Hexahydro-1(4H)-Naphthalenone

Molecule SVG Image

Properties Simple | Detailed

Formula C20H28O3
IUPAC Name (4r,4as,8as)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydronaphthalen-1-one
Molecular Mass 316.435 g·mol−1
Heat of Formation -498.7 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 399.84 Å 3
Surface Area 319.49 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (4r,4as,8as)-4-(2-furan-3-ylethyl)-4-hydroxy-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydronaphthalen-1-one
  • (4r,4as,8as)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydronaphthalen-1-one
  • solidagenone
InChIKey XDYGCIOWNPNVIH-YSIASYRMSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O