5-(Methoxycarbonyl)pyridine-2-carboxylic acid
5-methoxycarbonylpyridine-2-carboxylic acid
Also Known As: 5-(Methoxycarbonyl)picolinic acid|5-(methoxycarbonyl)pyridine-2-carboxylic acid|Coumalic acid|5-(Methoxycarbonyl)-2-pyridinecarboxylic acid|5-Methoxycarbonylpyridine-2-carboxylic acid|Maybridge3_005119|Jsp003679|(Phenylthiomethyl)trimethylsilane|5-(Methoxycarbonyl)picolinicacid|pyridine-2,5-dicarboxylic acid 5-methyl ester|5-(methoxycarbonyl)-picolinic acid|5-(methoxycarbonyl)pyridine-2-carboxylate|CL0321|CM-787|CS-W004726|QC-8370
| Molecular Formula | C8H7NO4 |
|---|---|
| Molecular Weight | 181.0375 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.0375 |
| Monoisotopic Mass | 181.0375 |
| Heavy Atoms | 13 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 17874-79-2 |
|---|---|
| SMILES | COC(=O)C1=CN=C(C=C1)C(=O)O |
| InChIKey | NTCKZTBRFXTYBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Methoxycarbonyl)pyridine-2-carboxylic acid (CAS 17874-79-2), with molecular formula C8H7NO4 and molecular weight 181.0375 g/mol. IUPAC: 5-methoxycarbonylpyridine-2-carboxylic acid.