| CAS Number | 932705-78-7 |
| Catalog Number | AG01CCUK(AGN-PC-0WOKJ3) |
| Chemical Name | 5-Fluoro-6-methylnicotinic acid |
| IUPAC Name | 5-fluoro-6-methylpyridine-3-carboxylic acid |
| InChI | InChI=1S/C7H6FNO2/c1-4-6(8)2-5(3-9-4)7(10)11/h2-3H,1H3,(H,10,11) |
| InChI Key | LKTUUSBGSVWDAL-UHFFFAOYSA-N |
| MDL Number | MFCD16988742 |
| Molecular Formula | C7H6FNO2 |
| Molecular Weight | 155.1264 |
| SMILES | FC=1C(=NC=C(C(=O)O)C1)C |
| Synonyms | 5-FLUORO-6-METHYLNICOTINIC ACID,
932705-78-7,
5-FLUORO-6-METHYLPYRIDINE-3-CARBOXYLIC ACID,
SCHEMBL114191,
5-fluoro-6-methyl-nicotinic acid,
LKTUUSBGSVWDAL-UHFFFAOYSA-N,
ZINC82406837,
AB71562,
CS-13164,
CS-0043478,
A1-07265,
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| 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 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number