2-{3-Hydroxy-4-[(2R)-2-Hydroxy-6-Methyl-2-Heptanyl]Benzyl}-5-(3-Hydroxy-5-Methylphenoxy)-3-Methylphenol

Molecule SVG Image

Properties Simple | Detailed

Formula C29H36O5
IUPAC Name 2-[[3-hydroxy-4-[(1r)-1-hydroxy-1,5-dimethyl-hexyl]phenyl]methyl]-5-(3-hydroxy-5-methyl-phenoxy)-3-methyl-phenol
Molecular Mass 464.593 g·mol−1
Heat of Formation -933.1 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 583.22 Å 3
Surface Area 426.87 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
InChIKey GGHNFGXGXUVHRJ-GDLZYMKVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O