cholest-5-en-3-yl 2-bromo-3-methylbutanoate
Chemical Structure Depiction of
cholest-5-en-3-yl 2-bromo-3-methylbutanoate
cholest-5-en-3-yl 2-bromo-3-methylbutanoate
Compound characteristics
| Compound ID: | 0199-0012 |
| Compound Name: | cholest-5-en-3-yl 2-bromo-3-methylbutanoate |
| Molecular Weight: | 549.68 |
| Molecular Formula: | C32 H53 Br O2 |
| Smiles: | CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C(C(C)C)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 9.2662 |
| logD: | 9.2662 |
| logSw: | -5.8546 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.7216 |
| InChI Key: | JWEOPRVXJUYGSP-UHFFFAOYSA-N |