3,6-Dichloropyridine-2-carboxylic acid 1-oxide
TL;DR: 3,6-Dichloropyridine-2-carboxylic acid 1-oxide (CAS 327098-90-8) is a chemical compound with molecular formula C6H3Cl2NO3 and molecular weight 206.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dichloro-1-oxidopyridin-1-ium-2-carboxylic acid
Also Known As: 2-carboxy-3,6-dichloropyridine 1-oxide, 3,6-dichloropyridine-2-carboxylic acid 1-oxide, 2,5-dichloro-1-oxido-pyridine-6-carboxylic Acid, 3,6-dichloro-1-oxidopyridin-1-ium-2-carboxylic acid
| Molecular Formula | C6H3Cl2NO3 |
|---|---|
| Molecular Weight | 206.95 g/mol |
| LogP | 1.325 |
| Topological Polar Surface Area | 64.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.949 |
| Heavy Atoms | 12 |
| Complexity | 339.81024 |
Chemical Identifiers
| CAS Number | 327098-90-8 |
|---|---|
| SMILES | C1=CC(=[N+](C(=C1Cl)C(=O)O)[O-])Cl |
Product Overview
3,6-Dichloropyridine-2-carboxylic acid 1-oxide (CAS 327098-90-8), with molecular formula C6H3Cl2NO3 and molecular weight 206.95 g/mol. IUPAC: 3,6-dichloro-1-oxidopyridin-1-ium-2-carboxylic acid.
Chemical Property Profile of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide
Property Insights of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide
The XLogP value of 1.325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Dichloropyridine-2-carboxylic acid 1-oxide. The TPSA of 64.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Dichloropyridine-2-carboxylic acid 1-oxide. Following Lipinski's Rule of Five, 3,6-Dichloropyridine-2-carboxylic acid 1-oxide has 1 hydrogen bond donor(s) and 2 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 3,6-Dichloropyridine-2-carboxylic acid 1-oxide?
The CAS number of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide is 327098-90-8.
What is the molecular formula of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide?
The molecular formula of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide is C6H3Cl2NO3.
What is the molecular weight of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide?
The molecular weight of 3,6-Dichloropyridine-2-carboxylic acid 1-oxide is 206.95 g/mol.
Where can I buy 3,6-Dichloropyridine-2-carboxylic acid 1-oxide?
You can request a quote for 3,6-Dichloropyridine-2-carboxylic acid 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dichloropyridine-2-carboxylic acid 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dichloropyridine-2-carboxylic acid 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.