| CAS Number | 1211584-03-0 |
| Catalog Number | AG019Z6J |
| Chemical Name | 4-Chloro-2-fluoropyridine-3-carboxylic acid |
| IUPAC Name | 4-chloro-2-fluoropyridine-3-carboxylic acid |
| InChI | InChI=1S/C6H3ClFNO2/c7-3-1-2-9-5(8)4(3)6(10)11/h1-2H,(H,10,11) |
| InChI Key | PJBJFVZQXPBZRC-UHFFFAOYSA-N |
| MDL Number | MFCD15143390 |
| Molecular Formula | C6H3ClFNO2 |
| Molecular Weight | 175.5449 |
| SMILES | ClC1=C(C(=NC=C1)F)C(=O)O |
| Synonyms | 4-Chloro-2-fluoropyridine-3-carboxylic acid,
1211584-03-0,
DTXSID90704601,
ZINC71256027,
AB70640,
4-CHLORO-2-FLUORONICOTINIC ACID,
DB-083197,
N/A,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.543g/mol |
| Monoisotopic Mass | 174.984g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number