65S
Summary
Name: | 3-fluoro-2-oxopropanoic acid |
Formula: | C3 H3 F O3 |
Formal charge: | 0 |
Formula weight: | 106.053 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 3-fluoro-2-oxopropanoic acid |
OpenEye OEToolkits | 2.0.4 | 3-fluoranyl-2-oxidanylidene-propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC(=O)C(CF)=O |
InChI | InChI | 1.03 | InChI=1S/C3H3FO3/c4-1-2(5)3(6)7/h1H2,(H,6,7) |
InChIKey | InChI | 1.03 | CXABZTLXNODUTD-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C(=O)CF |
SMILES | CACTVS | 3.385 | OC(=O)C(=O)CF |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C(C(=O)C(=O)O)F |
SMILES | OpenEye OEToolkits | 2.0.4 | C(C(=O)C(=O)O)F |