| CAS Number | 851386-30-6 |
| Catalog Number | AG01B7XY(AGN-PC-0NI00P) |
| Chemical Name | 5-Chloro-6-fluoropyridine-2-carboxylic acid |
| IUPAC Name | 5-chloro-6-fluoropyridine-2-carboxylic acid |
| InChI | InChI=1S/C6H3ClFNO2/c7-3-1-2-4(6(10)11)9-5(3)8/h1-2H,(H,10,11) |
| InChI Key | WTILAJRFMOOXAI-UHFFFAOYSA-N |
| MDL Number | MFCD09031170 |
| Molecular Formula | C6H3ClFNO2 |
| Molecular Weight | 175.5449 |
| SMILES | OC(C1=NC(F)=C(Cl)C=C1)=O |
| Synonyms | 5-chloro-6-fluoropyridine-2-carboxylic acid,
851386-30-6,
5-Chloro-6-fluoro-pyridine-2-carboxylic acid,
CTK7I7781,
ZINC21991272,
AKOS006290075,
AB49341,
5-CHLORO-6-FLUOROPICOLINIC ACID,
3-CHLORO-2-FLUORO-6-PYRIDINECARBOXYLIC ACID,
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| 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 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number