Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate
[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] 3,5-dinitrobenzoate
Also Known As: Cholesta-5, 3,5-dinitrobenzoate|Dehydrocholesterol 3,5-dinitrobenzoate|Cholesta-5,7-dien-3-yl 3,5-dinitrobenzoate|Cholesta-5,7-dien-3.beta.-ol, 3,5-dinitrobenzoate|Cholesta-5, 3,5-dinitrobenzoate, (3.beta.)-|Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate|CHOLESTA-5,7-DIEN-3-BETA-YL 3',5'-DINITROBENZOATE|Cholesta-5,7-dien-3-ol, 3,5-dinitrobenzoate, (3.beta.)-|[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] 3,5-dinitrobenzoate
| Molecular Formula | C34H46N2O6 |
|---|---|
| Molecular Weight | 578.3356 g/mol |
| LogP | 9.8 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 578.3356 |
| Monoisotopic Mass | 578.3356 |
| Heavy Atoms | 42 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 5895-91-0 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])C)C |
| InChIKey | MHKATTFAVWBPBV-UHFFFAOYSA-N |
Product Overview
Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate (CAS 5895-91-0), with molecular formula C34H46N2O6 and molecular weight 578.3356 g/mol. IUPAC: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] 3,5-dinitrobenzoate.
Cholesta-5,7-dien-3beta-ol, 3,5-dinitrobenzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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