(1S,2R,4As,4Br,6Ar,8R,10As,10Bs,12As)-2,10A,12A-Trimethyloctadecahydro-1,8-Chrysenediol
Properties
Property | Value |
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Formula | C21H36O2 |
IUPAC Name | (1s,2r,4as,4br,6ar,8r,10as,10bs,12as)-2,10a,12a-trimethyl-1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-hexadecahydrochrysene-1,8-diol |
Molecular Mass | 320.509 g·mol−1 |
Heat of Formation | -692.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.00 ± 1.08 D |
Volume | 422.1 Å 3 |
Surface Area | 328.36 Å 2 |
HOMO Energy | -9.85 ± 0.55 eV |
LUMO Energy | 2.94 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | HUPSBBUECCCNKS-YAWPOEEYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |