4-(1-Pyrrolidinyl)benzoic acid
- Product Name4-(1-Pyrrolidinyl)benzoic acid
- CAS22090-27-3
- MFC11H13NO2
- MW191.23
- EINECS
- MOL File22090-27-3.mol
Chemical Properties
| Melting point | 262-296 °C (D) |
| Boiling point | 376.9±25.0 °C(Predicted) |
| Density | 1+-.0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 4.94±0.10(Predicted) |
| form | solid |
| color | Cream |
| InChI | 1S/C11H13NO2/c13-11(14)9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2,(H,13,14) |
| InChIKey | KPCBFFYRSJPCJH-UHFFFAOYSA-N |
| SMILES | OC(=O)c1ccc(cc1)N2CCCC2 |
| CAS DataBase Reference | 22090-27-3(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26 |
| WGK Germany | 3 |
| Hazard Note | Harmful |
| HazardClass | IRRITANT |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |