| CAS Number | 1094345-91-1 |
| Catalog Number | AG00957R |
| Chemical Name | 2-fluoro-5-methylpyridine-4-carboxylic acid |
| IUPAC Name | 2-fluoro-5-methylpyridine-4-carboxylic acid |
| InChI | InChI=1S/C7H6FNO2/c1-4-3-9-6(8)2-5(4)7(10)11/h2-3H,1H3,(H,10,11) |
| InChI Key | DSDTZXBKLGFIEZ-UHFFFAOYSA-N |
| MDL Number | MFCD16611273 |
| Molecular Formula | C7H6FNO2 |
| Molecular Weight | 155.1264 |
| SMILES | CC1=C(C(O)=O)C=C(F)N=C1 |
| Synonyms | 2-FLUORO-5-METHYLISONICOTINIC ACID,
1094345-91-1,
SCHEMBL4754751,
AKOS030527623,
AB71348,
4-Pyridinecarboxylic acid, 2-fluoro-5-methyl-,
2-FLUORO-5-METHYLPYRIDINE-4-CARBOXYLIC ACID,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.128g/mol |
| Monoisotopic Mass | 155.038g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number