6-(3-Chlorobenzyl)-3-pyridazinol
TL;DR: 6-(3-Chlorobenzyl)-3-pyridazinol (CAS 339008-48-9) is a chemical compound with molecular formula C11H9ClN2O and molecular weight 220.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-chlorophenyl)methyl]-1H-pyridazin-6-one
Also Known As: 6-(3-chlorobenzyl)-3-pyridazinol, 6-[(3-chlorophenyl)methyl]pyridazin-3-ol, 3-[(3-chlorophenyl)methyl]-1H-pyridazin-6-one, 7E-045
| Molecular Formula | C11H9ClN2O |
|---|---|
| Molecular Weight | 220.04 g/mol |
| LogP | 2.0141 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.04034 |
| Heavy Atoms | 15 |
| Complexity | 501.4964 |
Chemical Identifiers
| CAS Number | 339008-48-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)CC2=NNC(=O)C=C2 |
Product Overview
6-(3-Chlorobenzyl)-3-pyridazinol (CAS 339008-48-9), with molecular formula C11H9ClN2O and molecular weight 220.04 g/mol. IUPAC: 3-[(3-chlorophenyl)methyl]-1H-pyridazin-6-one.
Chemical Property Profile of 6-(3-Chlorobenzyl)-3-pyridazinol
Property Insights of 6-(3-Chlorobenzyl)-3-pyridazinol
The XLogP value of 2.0141 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3-Chlorobenzyl)-3-pyridazinol. With a topological polar surface area (TPSA) of 45.75 Ų, 6-(3-Chlorobenzyl)-3-pyridazinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3-Chlorobenzyl)-3-pyridazinol 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 6-(3-Chlorobenzyl)-3-pyridazinol?
The CAS number of 6-(3-Chlorobenzyl)-3-pyridazinol is 339008-48-9.
What is the molecular formula of 6-(3-Chlorobenzyl)-3-pyridazinol?
The molecular formula of 6-(3-Chlorobenzyl)-3-pyridazinol is C11H9ClN2O.
What is the molecular weight of 6-(3-Chlorobenzyl)-3-pyridazinol?
The molecular weight of 6-(3-Chlorobenzyl)-3-pyridazinol is 220.04 g/mol.
Where can I buy 6-(3-Chlorobenzyl)-3-pyridazinol?
You can request a quote for 6-(3-Chlorobenzyl)-3-pyridazinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Chlorobenzyl)-3-pyridazinol?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Chlorobenzyl)-3-pyridazinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.