Isonicotinic Acid
Chemical Information
Isonicotinic acid is a pyridinemonocarboxylic acid in which the carboxy group is at position 4 of the pyridine ring. It has a role as a human metabolite and an algal metabolite. It is a conjugate acid of an isonicotinate.
| CAS Number | 55-22-1 |
| PubChem CID | 5922 |
| IUPAC Name | pyridine-4-carboxylic acid |
| Molecular Formula | C6H5NO2 |
| Molecular Weight | 123.11 |
| XLogP | 0.4 |
| Topological Polar Surface Area | 50.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 108 |
| Property | Value |
|---|---|
| Molecular Weight | 123.11 |
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 123.032028402 |
| Monoisotopic Mass | 123.032028402 |
| Topological Polar Surface Area | 50.2 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 108 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
Related Products
Alternative Products
| Catalog | Name |
|---|---|
| 280701-01 | Isonicotinic acid |
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