4-(6-chloropyridazin-3-yl)benzoic Acid
TL;DR: 4-(6-chloropyridazin-3-yl)benzoic Acid (CAS 845829-90-5) is a chemical compound with molecular formula C11H7ClN2O2 and molecular weight 234.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-chloropyridazin-3-yl)benzoic acid
Also Known As: 4-(6-chloropyridazin-3-yl)benzoic Acid, 4- BENZOICACID, 4-(6-chloro-3-pyridazinyl)benzoic acid, 1-(2-ethenoxyethyl)pyrazole, 4-(6-Chloropyridazin-3-yl)benzoicacid
| Molecular Formula | C11H7ClN2O2 |
|---|---|
| Molecular Weight | 234.02 g/mol |
| LogP | 2.4952 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0196 |
| Heavy Atoms | 16 |
| Complexity | 508.5127 |
Chemical Identifiers
| CAS Number | 845829-90-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=C(C=C2)Cl)C(=O)O |
Product Overview
4-(6-chloropyridazin-3-yl)benzoic Acid (CAS 845829-90-5), with molecular formula C11H7ClN2O2 and molecular weight 234.02 g/mol. IUPAC: 4-(6-chloropyridazin-3-yl)benzoic acid.
Chemical Property Profile of 4-(6-chloropyridazin-3-yl)benzoic Acid
Property Insights of 4-(6-chloropyridazin-3-yl)benzoic Acid
The XLogP value of 2.4952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(6-chloropyridazin-3-yl)benzoic Acid. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-chloropyridazin-3-yl)benzoic Acid. Following Lipinski's Rule of Five, 4-(6-chloropyridazin-3-yl)benzoic 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 4-(6-chloropyridazin-3-yl)benzoic Acid?
The CAS number of 4-(6-chloropyridazin-3-yl)benzoic Acid is 845829-90-5.
What is the molecular formula of 4-(6-chloropyridazin-3-yl)benzoic Acid?
The molecular formula of 4-(6-chloropyridazin-3-yl)benzoic Acid is C11H7ClN2O2.
What is the molecular weight of 4-(6-chloropyridazin-3-yl)benzoic Acid?
The molecular weight of 4-(6-chloropyridazin-3-yl)benzoic Acid is 234.02 g/mol.
Where can I buy 4-(6-chloropyridazin-3-yl)benzoic Acid?
You can request a quote for 4-(6-chloropyridazin-3-yl)benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(6-chloropyridazin-3-yl)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(6-chloropyridazin-3-yl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.