55528-08-0
| Name | (-)-BUTACLAMOL HCL |
| CAS | 55528-08-0 |
| Molecular Formula | C25H31NO.ClH |
| MDL Number | MFCD00082308 |
| Molecular Weight | 397.987 |
| MOL File | 55528-08-0.mol |
Chemical Properties
| solubility | H2O: 0.25 mg/mL |
| form | solid |
| color | white |
| Optical Rotation | [α]27/D 222° in methanol(lit.) |
| Water Solubility | H2O: 0.25mg/mL ethanol: 1mg/mL 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 5.4mg/mL alcohol-water mixtures: soluble (Dissolve solid in alcohol and dilute with water.) |
| InChI | 1S/C25H31NO.ClH/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25;/h4-10,21-22,27H,11-16H2,1-3H3;1H/t21-,22-,25-;/m1./s1 |
| InChIKey | QZRUMKUMFJJARD-OMMJFLKZSA-N |
| SMILES | Cl[H].[H][C@]12C[C@](O)(CCN1C[C@]3([H])c4ccccc4CCc5cccc2c35)C(C)(C)C |