Labetalone hydrochloride
- Product NameLabetalone hydrochloride
- CAS96441-14-4
- CBNumberCB6460516
- MFC19H22N2O3.ClH
- MW362.86
- EINECS700-288-4
- MDL NumberMFCD08460398
- MOL File96441-14-4.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 125-128 °C(lit.) |
| Boiling point | 523.92℃[at 101 325 Pa] |
| storage temp. | Store at -20°C |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| color | White to Off-White |
| Water Solubility | 28.61mg/L at 25℃ |
| Major Application | pharmaceutical (small molecule) |
| InChI | 1S/C19H22N2O3.ClH/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24;/h2-6,9-11,13,21-22H,7-8,12H2,1H3,(H2,20,24);1H |
| InChIKey | DJHFVUYXWAEVRA-UHFFFAOYSA-N |
| SMILES | Cl.N(C(CCc2ccccc2)C)CC(=O)c1cc(c(cc1)O)C(=O)N |
| LogP | 3.58 |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
Safety
| Symbol(GHS) |
 
|
| Signal word | Warning |
| Hazard statements | H315-H361-H319-H335 |
| Precautionary statements | P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P201-P202-P281-P308+P313-P405-P501 |
| Hazard Codes | Xn |
| Risk Statements | 22 |
| Safety Statements | 22-24/25 |
| WGK Germany | 1 |
| RTECS | CU8700000 |
| Storage Class | 11 - Combustible Solids |
