Betulin
Properties
Property | Value |
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Formula | C30H50O2 |
IUPAC Name | (1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3a-(hydroxymethyl)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol |
Molecular Mass | 442.717 g·mol−1 |
Heat of Formation | -289.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.28 ± 1.08 D |
Volume | 578.33 Å 3 |
Surface Area | 414.32 Å 2 |
HOMO Energy | -9.39 ± 0.55 eV |
LUMO Energy | 0.43 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | FVWJYYTZTCVBKE-ROUWMTJPSA-N |
QR Code | Generate QR Code |
Links | PubChem Wikipedia ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |