(3S,4Ar,6Ar,7S,8S,10Ar,10Bs,12As)-7-(2-Carboxyethyl)-8-Isopropenyl-3,7,10A,10B,12A-Pentamethyl-1,2,3,4,4A,6,6A,7,8,9,10,10A,10B,11,12,12A-Hexadecahydro-3-Chrysenecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C30H46O4 |
IUPAC Name | (3s,4ar,6ar,7s,8s,10ar,10bs,12as)-7-(2-carboxyethyl)-8-isopropenyl-3,7,10a,10b,12a-pentamethyl-2,4,4a,6,6a,8,9,10,11,12-decahydro-1h-chrysene-3-carboxylic acid |
Molecular Mass | 470.684 g·mol−1 |
Heat of Formation | -1014.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.90 ± 1.08 D |
Volume | 606.47 Å 3 |
Surface Area | 441.71 Å 2 |
HOMO Energy | -9.13 ± 0.55 eV |
LUMO Energy | 3.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | ASOUKQDZWGOCBR-ICSARBIRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |