2,6-Dimethyl-3,4-pyridinedicarboxylic acid
TL;DR: 2,6-Dimethyl-3,4-pyridinedicarboxylic acid (CAS 13602-84-1) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethylpyridine-3,4-dicarboxylic acid
Also Known As: 2,6-dimethylpyridine-3,4-dicarboxylic acid, 2,6-Dimethyl-3,4-pyridinedicarboxylic acid, 2,6-Dimethylpyridine-3,4-dicarboxylicacid, Pyridine-3,4-dicarboxylic acid, 2,6-dimethyl-, 2,6-Dimethyl-3,4-pyridinedicarboxylic acid #
| Molecular Formula | C9H9NO4 |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.05316 |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 13602-84-1 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)C)C(=O)O)C(=O)O |
| InChIKey | LLSUEYTYYZRPGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dimethyl-3,4-pyridinedicarboxylic acid (CAS 13602-84-1), with molecular formula C9H9NO4 and molecular weight 195.05 g/mol. IUPAC: 2,6-dimethylpyridine-3,4-dicarboxylic acid.
Chemical Property Profile of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid
Property Insights of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyl-3,4-pyridinedicarboxylic acid. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dimethyl-3,4-pyridinedicarboxylic acid. Following Lipinski's Rule of Five, 2,6-Dimethyl-3,4-pyridinedicarboxylic acid has 2 hydrogen bond donor(s) and 5 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 2,6-Dimethyl-3,4-pyridinedicarboxylic acid?
The CAS number of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid is 13602-84-1.
What is the molecular formula of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid?
The molecular formula of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid is C9H9NO4.
What is the molecular weight of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid?
The molecular weight of 2,6-Dimethyl-3,4-pyridinedicarboxylic acid is 195.05 g/mol.
Where can I buy 2,6-Dimethyl-3,4-pyridinedicarboxylic acid?
You can request a quote for 2,6-Dimethyl-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 2,6-Dimethyl-3,4-pyridinedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyl-3,4-pyridinedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.