OBF
Summary
| Name: | (2S)-2-amino-4,4-difluorobutanoic acid |
| Formula: | C4 H7 F2 N O2 |
| Formal charge: | 0 |
| Formula weight: | 139.101 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-2-amino-4,4-difluorobutanoic acid |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-4,4-difluoro-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | FC(F)CC(N)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CC(F)F)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](CC(F)F)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H](C(=O)O)N)C(F)F |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(=O)O)N)C(F)F |
| InChI | InChI | 1.03 | InChI=1S/C4H7F2NO2/c5-3(6)1-2(7)4(8)9/h2-3H,1,7H2,(H,8,9)/t2-/m0/s1 |
| InChIKey | InChI | 1.03 | VIUCNIMDPZQXAD-REOHCLBHSA-N |
