TFA
Summary
Name: | trifluoroacetic acid |
Formula: | C2 H F3 O2 |
Formal charge: | 0 |
Formula weight: | 114.023 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | trifluoroacetic acid |
OpenEye OEToolkits | 1.7.0 | 2,2,2-trifluoroethanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | FC(F)(F)C(=O)O |
SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)C(F)(F)F |
SMILES | CACTVS | 3.370 | OC(=O)C(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(=O)(C(F)(F)F)O |
SMILES | OpenEye OEToolkits | 1.7.0 | C(=O)(C(F)(F)F)O |
InChI | InChI | 1.03 | InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7) |
InChIKey | InChI | 1.03 | DTQVDTLACAAQTR-UHFFFAOYSA-N |