5alpha-Cholestan-3beta,5alpha-diol-6-one
- Product Name5alpha-Cholestan-3beta,5alpha-diol-6-one
- CAS13027-33-3
- CBNumberCB5493423
- MFC27H46O3
- MW418.65
- MDL NumberMFCD00271438
- MOL File13027-33-3.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 234 °C |
| Boiling point | 528.9±45.0 °C(Predicted) |
| Density | 1.061±0.06 g/cm3(Predicted) |
| storage temp. | Store at -20°C |
| solubility | DMF: 20 mg/ml; DMSO: 0.5 mg/ml; Ethanol: 5 mg/ml |
| form | A crystalline solid |
| pka | 12+-.0.70(Predicted) |
| color | White to off-white |
| InChIKey | SJZZRXMQSAXCFD-ZCBMJONGSA-N |
| SMILES | O[C@]21[C@@]([C@@H]3[C@H]([C@H]4[C@@]([C@H](CC4)[C@@H](CCCC(C)C)C)(CC3)C)CC2=O)(CC[C@@H](C1)O)C |
| FDA UNII | YO7G6S09N3 |
| UNSPSC Code | 12352211 |
| NACRES | NA.25 |
