5,6-dibromocholestan-3-yl 3-chlorobutanoate
Chemical Structure Depiction of
5,6-dibromocholestan-3-yl 3-chlorobutanoate
5,6-dibromocholestan-3-yl 3-chlorobutanoate
Compound characteristics
| Compound ID: | 8016-6266 |
| Compound Name: | 5,6-dibromocholestan-3-yl 3-chlorobutanoate |
| Molecular Weight: | 651.01 |
| Molecular Formula: | C31 H51 Br2 Cl O2 |
| Smiles: | CC(C)CCCC(C)C1CCC2C3CC(C4(CC(CCC4(C)C3CCC12C)OC(CC(C)[Cl])=O)[Br])[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 9.3125 |
| logD: | 9.3125 |
| logSw: | -6.0205 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.1266 |
| InChI Key: | XROACRVMHWKIOK-UHFFFAOYSA-N |