Isonicotinic acid, pentyl ester
pentyl pyridine-4-carboxylate
Also Known As: pentyl isonicotinate|Isonicotinic acid, pentyl ester|pentyl pyridine-4-carboxylate|Isonicotinic acid pentyl ester|Isonicotinsaeure-pentylester
CAS: 77237-03-7
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11028 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 193.11028 |
| Monoisotopic Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 77237-03-7 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=NC=C1 |
| InChIKey | MZHSESFNXADKBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Polymer Intermediates (8 patents)
Product Overview
Isonicotinic acid, pentyl ester (CAS 77237-03-7), with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol. IUPAC: pentyl pyridine-4-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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