(2S,4S)-1-(tert-Butoxycarbonyl)-4-(2-fluoro-phenoxy)-2-pyrrolidinecarboxylic acid
- Product Name(2S,4S)-1-(tert-Butoxycarbonyl)-4-(2-fluoro-phenoxy)-2-pyrrolidinecarboxylic acid
- CAS686766-52-9
- CBNumberCB9832109
- MFC16H20FNO5
- MW325.33
- MDL NumberMFCD08687112
- MOL FileMol file
Chemical Properties
| Boiling point | 463.6±45.0 °C(Predicted) |
| Density | 1.286±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 3.66±0.40(Predicted) |
| InChI | 1S/C16H20FNO5/c1-16(2,3)23-15(21)18-9-10(8-12(18)14(19)20)22-13-7-5-4-6-11(13)17/h4-7,10,12H,8-9H2,1-3H3,(H,19,20)/t10-,12-/m0/s1 |
| InChIKey | AUSMQEAACFWSDK-JQWIXIFHSA-N |
| SMILES | FC1=C(O[C@@H]2CN(C(OC(C)(C)C)=O)[C@H](C(O)=O)C2)C=CC=C1 |
| UNSPSC Code | 12352101 |
Safety
| Hazard Codes | Xi |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |