Summary
| Name: | 4,4-difluoro-L-proline |
| Formula: | C5 H7 F2 N O2 |
| Formal charge: | 0 |
| Formula weight: | 151.111 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4,4-difluoro-L-proline |
| OpenEye OEToolkits | 1.5.0 | (2S)-4,4-difluoropyrrolidine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C1NCC(F)(F)C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)[C@@H]1CC(F)(F)CN1 |
| SMILES | CACTVS | 3.341 | OC(=O)[CH]1CC(F)(F)CN1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@H](NCC1(F)F)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1C(NCC1(F)F)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H7F2NO2/c6-5(7)1-3(4(9)10)8-2-5/h3,8H,1-2H2,(H,9,10)/t3-/m0/s1 |
| InChIKey | InChI | 1.03 | ZPBIYZHGBPBZCK-VKHMYHEASA-N |
