3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate
TL;DR: 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate (CAS 74037-36-8) is a chemical compound with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl (6-oxo-1H-pyridazin-3-yl) carbonate
Also Known As: 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate, 6-Hydroxy-3(2H)-pyridazinone isobutoxycarboxylate, Isobutyl 2,3-dihydro-3-oxo-6-pyridazinyl carbonate, 2-methylpropyl (6-oxo-1H-pyridazin-3-yl) carbonate, 4-25-00-00025 (Beilstein Handbook Reference)
| Molecular Formula | C9H12N2O4 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | 0.9413 |
| Topological Polar Surface Area | 81.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.07971 |
| Heavy Atoms | 15 |
| Complexity | 365.44876 |
Chemical Identifiers
| CAS Number | 74037-36-8 |
|---|---|
| SMILES | CC(C)COC(=O)OC1=NNC(=O)C=C1 |
Product Overview
3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate (CAS 74037-36-8), with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol. IUPAC: 2-methylpropyl (6-oxo-1H-pyridazin-3-yl) carbonate.
Chemical Property Profile of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate
Property Insights of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate
The XLogP value of 0.9413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate. The TPSA of 81.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate. Following Lipinski's Rule of Five, 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate has 1 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 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate?
The CAS number of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate is 74037-36-8.
What is the molecular formula of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate?
The molecular formula of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate is C9H12N2O4.
What is the molecular weight of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate?
The molecular weight of 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate is 212.08 g/mol.
Where can I buy 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate?
You can request a quote for 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Pyridazinone, 6-hydroxy-, isobutoxycarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.