Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate
TL;DR: Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate (CAS 220967-67-9) is a chemical compound with molecular formula C7H6Cl2N2O3 and molecular weight 235.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4,5-dichloro-6-oxopyridazin-1-yl)acetate
Also Known As: Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate, J1.048.534G, methyl 2-(4,5-dichloro-6-oxopyridazin-1-yl)acetate, AE-848/11905067, methyl 2-(4,5-dichloro-6-oxo-pyridazin-1-yl)acetate
| Molecular Formula | C7H6Cl2N2O3 |
|---|---|
| Molecular Weight | 235.98 g/mol |
| LogP | 0.7231 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.97554 |
| Heavy Atoms | 14 |
| Complexity | 415.8862 |
Chemical Identifiers
| CAS Number | 220967-67-9 |
|---|---|
| SMILES | COC(=O)CN1C(=O)C(=C(C=N1)Cl)Cl |
Product Overview
Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate (CAS 220967-67-9), with molecular formula C7H6Cl2N2O3 and molecular weight 235.98 g/mol. IUPAC: methyl 2-(4,5-dichloro-6-oxopyridazin-1-yl)acetate.
Chemical Property Profile of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate
Property Insights of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate
The XLogP value of 0.7231 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate. Following Lipinski's Rule of Five, Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate has 0 hydrogen bond donor(s) and 4 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 Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate?
The CAS number of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate is 220967-67-9.
What is the molecular formula of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate?
The molecular formula of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate is C7H6Cl2N2O3.
What is the molecular weight of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate?
The molecular weight of Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate is 235.98 g/mol.
Where can I buy Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate?
You can request a quote for Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4,5-dichloro-6-oxopyridazin-1(6H)-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.