6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid
TL;DR: 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid (CAS 343349-06-4) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-2-ethylpyridine-3,4-dicarboxylic acid
Also Known As: 6-tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid, 6-tert-butyl-2-ethylpyridine-3,4-dicarboxylic acid, 6-(tert-butyl)-2-ethylpyridine-3,4-dicarboxylic acid
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 2.3379 |
| Topological Polar Surface Area | 87.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 500.4481 |
Chemical Identifiers
| CAS Number | 343349-06-4 |
|---|---|
| SMILES | CCC1=C(C(=CC(=N1)C(C)(C)C)C(=O)O)C(=O)O |
Product Overview
6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid (CAS 343349-06-4), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: 6-tert-butyl-2-ethylpyridine-3,4-dicarboxylic acid.
Chemical Property Profile of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid
Property Insights of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid
The XLogP value of 2.3379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid. The TPSA of 87.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid. Following Lipinski's Rule of Five, 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid has 2 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 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid?
The CAS number of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid is 343349-06-4.
What is the molecular formula of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid?
The molecular formula of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid is C13H17NO4.
What is the molecular weight of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid?
The molecular weight of 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid is 251.12 g/mol.
Where can I buy 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid?
You can request a quote for 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Tert-butyl-2-ethyl-3,4-pyridinedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.