2848-96-6
| Name | 3-(Acetyloxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one |
| CAS | 2848-96-6 |
| EINECS(EC#) | 220-653-7 |
| Molecular Formula | C17H12Cl2N2O3 |
| MDL Number | MFCD00869660 |
| Molecular Weight | 363.19 |
| MOL File | 2848-96-6.mol |
Chemical Properties
| Melting point | 243-245 °C |
| Boiling point | 524.4±50.0 °C(Predicted) |
| density | 1.45±0.1 g/cm3(Predicted) |
| form | neat |
| pka | 10.34±0.70(Predicted) |
| BRN | 764089 |
| Major Application | pharmaceutical (small molecule) |
| InChI | 1S/C17H12Cl2N2O3/c1-9(22)24-17-16(23)20-14-7-6-10(18)8-12(14)15(21-17)11-4-2-3-5-13(11)19/h2-8,17H,1H3,(H,20,23) |
| InChIKey | CYDZMDOLVUBPNL-UHFFFAOYSA-N |
| SMILES | CC(=O)OC1N=C(c2ccccc2Cl)c3cc(Cl)ccc3NC1=O |
| LogP | 3.24 |
Safety Data
| Symbol(GHS) |   GHS07,GHS09 |
| Signal word | Warning |
| Hazard statements | H302-H410 |
| Precautionary statements | P264-P270-P273-P301+P312-P391-P501 |
| Hazard Codes | Xn,N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 3077 9 / PGIII |
| WGK Germany | WGK 2 |
| REACH Registrations | Active |
| HS Code | 2933997500 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Acute 1 Aquatic Chronic 1 |