313674-97-4
| Name | PD-118057 |
| CAS | 313674-97-4 |
| Molecular Formula | C21H17Cl2NO2 |
| MDL Number | MFCD08705328 |
| Molecular Weight | 386.27 |
| MOL File | 313674-97-4.mol |
Chemical Properties
| Boiling point | 527.0±50.0 °C(Predicted) |
| density | 1.353±0.06 g/cm3(Predicted) |
| storage temp. | Store at -20°C |
| solubility | DMSO: soluble9mg/mL |
| form | solid |
| pka | 3.70±0.36(Predicted) |
| color | light yellow |
| InChI | InChI=1S/C21H17Cl2NO2/c22-18-12-9-15(13-19(18)23)6-5-14-7-10-16(11-8-14)24-20-4-2-1-3-17(20)21(25)26/h1-4,7-13,24H,5-6H2,(H,25,26) |
| InChIKey | ZCQOSCDABPVAFB-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=CC=C1NC1=CC=C(CCC2=CC=C(Cl)C(Cl)=C2)C=C1 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335-H413 |
| Precautionary statements | P273-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Chronic 4 Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |