Picolinic acid, 5-hexyl-
TL;DR: Picolinic acid, 5-hexyl- (CAS 717-83-9) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexylpyridine-2-carboxylic acid
Also Known As: 5-Hexylpicolinic acid, Picolinic acid, 5-hexyl-, 5-Hexyl-2-pyridinecarboxylic acid, 5-hexylpyridine-2-carboxylic acid, 2-Pyridinecarboxylic acid, 5-hexyl-
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 717-83-9 |
|---|---|
| SMILES | CCCCCCC1=CN=C(C=C1)C(=O)O |
| InChIKey | LRVWMFHQTPNPJY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Picolinic acid, 5-hexyl- (CAS 717-83-9), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 5-hexylpyridine-2-carboxylic acid.
Chemical Property Profile of Picolinic acid, 5-hexyl-
Property Insights of Picolinic acid, 5-hexyl-
The XLogP value of 3.7 indicates that Picolinic acid, 5-hexyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, Picolinic acid, 5-hexyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Picolinic acid, 5-hexyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Picolinic acid, 5-hexyl-?
The CAS number of Picolinic acid, 5-hexyl- is 717-83-9.
What is the molecular formula of Picolinic acid, 5-hexyl-?
The molecular formula of Picolinic acid, 5-hexyl- is C12H17NO2.
What is the molecular weight of Picolinic acid, 5-hexyl-?
The molecular weight of Picolinic acid, 5-hexyl- is 207.13 g/mol.
Where can I buy Picolinic acid, 5-hexyl-?
You can request a quote for Picolinic acid, 5-hexyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picolinic acid, 5-hexyl-?
Yes, KEHONG BIO provides custom synthesis services for Picolinic acid, 5-hexyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.