Hydroquinidine 4-chlorobenzoate
- Product NameHydroquinidine 4-chlorobenzoate
- CAS113162-02-0
- MFC27H29ClN2O3
- MW464.98
- EINECS
- MOL File113162-02-0.mol
Chemical Properties
| Melting point | 102-105 °C(lit.) |
| Boiling point | 598.0±40.0 °C(Predicted) |
| Density | 1.28±0.1 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| pka | 9.31±0.70(Predicted) |
| Appearance | White to off-white Solid |
| optical activity | [α]26/D 73°, c = 1 in ethanol |
| BRN | 4302319 |
| InChIKey | TXVNNFDXQZFMBQ-XHYUFEOFSA-N |
| SMILES | CC[C@@H]1CN2CCC1CC2[C@@H](OC(=O)c3ccc(Cl)cc3)c4ccnc5ccc(OC)cc45 |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-24/25-22 |
| RIDADR | 1544 |
| WGK Germany | 3 |
| HazardClass | 6.1(b) |
| PackingGroup | III |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
