| CAS Number | 1214375-37-7 |
| Catalog Number | AG0014X4(AGN-PC-07QVCE) |
| Chemical Name | Methyl 4-fluoropyridine-3-carboxylate |
| IUPAC Name | methyl 4-fluoropyridine-3-carboxylate |
| InChI | InChI=1S/C7H6FNO2/c1-11-7(10)5-4-9-3-2-6(5)8/h2-4H,1H3 |
| InChI Key | LNORHZUETHALBP-UHFFFAOYSA-N |
| MDL Number | MFCD14698050 |
| Molecular Formula | C7H6FNO2 |
| Molecular Weight | 155.1264 |
| SMILES | O=C(C1=C(F)C=CN=C1)OC |
| Synonyms | 1214375-37-7,
METHYL 4-FLUOROPYRIDINE-3-CARBOXYLATE,
3-Pyridinecarboxylic acid, 4-fluoro-, methyl ester,
METHYL 4-FLUORONICOTINATE,
ZINC47202394,
AKOS028114731,
AB70564,
SC-66127,
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| Complexity | 151 |
| 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 | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.128g/mol |
| Monoisotopic Mass | 155.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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