2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid
TL;DR: 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid (CAS 89581-61-3) is a chemical compound with molecular formula C6H5ClN2O3 and molecular weight 188.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-6-oxopyridazin-1-yl)acetic acid
Also Known As: (3-chloro-6-oxopyridazin-1(6H)-yl)acetic acid, (3-Chloro-6-oxo-6H-pyridazin-1-yl)-acetic acid, 2-(3-chloro-6-oxopyridazin-1-yl)acetic acid, 2-(3-chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid, 2-(3-chloro-6-oxo-pyridazin-1-yl)acetic Acid
| Molecular Formula | C6H5ClN2O3 |
|---|---|
| Molecular Weight | 188.00 g/mol |
| LogP | -0.0187 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.99887 |
| Heavy Atoms | 12 |
| Complexity | 360.056 |
Chemical Identifiers
| CAS Number | 89581-61-3 |
|---|---|
| SMILES | C1=CC(=O)N(N=C1Cl)CC(=O)O |
Product Overview
2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid (CAS 89581-61-3), with molecular formula C6H5ClN2O3 and molecular weight 188.00 g/mol. IUPAC: 2-(3-chloro-6-oxopyridazin-1-yl)acetic acid.
Chemical Property Profile of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid
Property Insights of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid
The XLogP value of -0.0187 indicates that 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid. Following Lipinski's Rule of Five, 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid 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 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid?
The CAS number of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid is 89581-61-3.
What is the molecular formula of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid?
The molecular formula of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid is C6H5ClN2O3.
What is the molecular weight of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid?
The molecular weight of 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid is 188.00 g/mol.
Where can I buy 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid?
You can request a quote for 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-6-oxo-1,6-dihydropyridazin-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.