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| Synonyms | picolinic acid | 98-98-6 | 2-Picolinic acid | Pyridine-2-carboxylic acid | 2-Pyridinecarboxylic acid | 2-Carboxypyridine | o-Pyridinecarboxylic acid | alpha-Picolinic acid | alpha-Pyridinecarboxylic acid | PYRIDINECARBOXYLIC ACID | Acide picolique | Pyridine-carboxylique-2 | MFC |
|---|---|
| Specifications & Purity | 10mM in DMSO |
| Storage Temp | Store at -80°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomy Tree
| Kingdom | Organic compounds |
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| Superclass | Organoheterocyclic compounds |
| Class | Pyridines and derivatives |
| Subclass | Pyridinecarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyridinecarboxylic acids |
| Alternative Parents | Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Pyridine carboxylic acid - Heteroaromatic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group. |
| External Descriptors | Piperidine alkaloids |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| IUPAC Name | pyridine-2-carboxylic acid |
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| INCHI | InChI=1S/C6H5NO2/c8-6(9)5-3-1-2-4-7-5/h1-4H,(H,8,9) |
| InChIKey | SIOXPEMLGUPBBT-UHFFFAOYSA-N |
| Smiles | C1=CC=NC(=C1)C(=O)O |
| Isomeric SMILES | C1=CC=NC(=C1)C(=O)O |
| WGK Germany | 3 |
| RTECS | TJ7344000 |
| Molecular Weight | 123.11 |
| Beilstein | 109595 |
| Reaxy-Rn | 109595 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109595&ln= |
| Flash Point(°F) | 232°F |
|---|---|
| Flash Point(°C) | 139℃ |
| Melt Point(°C) | 139-142°C |
| Molecular Weight | 123.110 g/mol |
| XLogP3 | 0.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 123.032 Da |
| Monoisotopic Mass | 123.032 Da |
| Topological Polar Surface Area | 50.200 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 114.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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