alpha-[(benzyl-tert-butylamino)methyl]-m-xylene-4,alpha,alpha'-triol
- Product Namealpha-[(benzyl-tert-butylamino)methyl]-m-xylene-4,alpha,alpha'-triol
- CAS24085-03-8
- MFC20H27NO3
- MW329.43
- EINECS246-013-7
- MOL File24085-03-8.mol
Chemical Properties
| Boiling point | 496.0±33.0 °C(Predicted) |
| Density | 1.162±0.06 g/cm3(Predicted) |
| pka | 9.95±0.31(Predicted) |
| form | solid |
| Major Application | pharmaceutical small molecule |
| InChI | 1S/C20H27NO3/c1-20(2,3)21(12-15-7-5-4-6-8-15)13-19(24)16-9-10-18(23)17(11-16)14-22/h4-11,19,22-24H,12-14H2,1-3H3 |
| InChIKey | NZBXAYHLQSMNQS-UHFFFAOYSA-N |
| SMILES | N(C(C)(C)C)(CC(O)c2cc(c(cc2)O)CO)Cc1ccccc1 |
| LogP | 2.79 |
Safety Information
| WGK Germany | WGK 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Chronic 3 |