| CAS Number | 1197231-27-8 |
| Catalog Number | AG019D1W(AGN-PC-0WBSC1) |
| Chemical Name | 6-Fluoro-pyrazine-2-carboxylic acid |
| IUPAC Name | 6-fluoropyrazine-2-carboxylic acid |
| InChI | InChI=1S/C5H3FN2O2/c6-4-2-7-1-3(8-4)5(9)10/h1-2H,(H,9,10) |
| InChI Key | LMDPXTJGCUZRAF-UHFFFAOYSA-N |
| MDL Number | MFCD22481001 |
| Molecular Formula | C5H3FN2O2 |
| Molecular Weight | 142.0879 |
| SMILES | OC(C1=NC(F)=CN=C1)=O |
| Synonyms | 6-Fluoro-pyrazine-2-carboxylic acid,
1197231-27-8,
6-fluoropyrazine-2-carboxylic acid,
0752AD,
ZINC60109085,
AKOS017344898,
FCH2273167,
PC53162,
C5H3FN2O2,
|
| Complexity | 142 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.089g/mol |
| Monoisotopic Mass | 142.018g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number