4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium
TL;DR: 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium (CAS 7217-76-7) is a chemical compound with molecular formula C6H7ClN2O and molecular weight 158.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3,6-dimethyl-1-oxidopyridazin-1-ium
Also Known As: 4-CHLORO-3,6-DIMETHYLPYRIDAZIN-1-IUM-1-OLATE, 4-chloro-3,6-dimethyl-1-oxidopyridazin-1-ium, 4-Chloro-3,6-dimethylpyridazine 1-oxide, 3,6-dimethyl-4-chloropyridazine 1-oxide, 4-chloro-3,6-dimethyl-1-oxido-pyridazine
| Molecular Formula | C6H7ClN2O |
|---|---|
| Molecular Weight | 158.02 g/mol |
| LogP | 0.98524 |
| Topological Polar Surface Area | 39.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 158.02469 |
| Heavy Atoms | 10 |
| Complexity | 211.91988 |
Chemical Identifiers
| CAS Number | 7217-76-7 |
|---|---|
| SMILES | CC1=CC(=C(N=[N+]1[O-])C)Cl |
Product Overview
4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium (CAS 7217-76-7), with molecular formula C6H7ClN2O and molecular weight 158.02 g/mol. IUPAC: 4-chloro-3,6-dimethyl-1-oxidopyridazin-1-ium.
Chemical Property Profile of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium
Property Insights of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium
The XLogP value of 0.98524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium. With a topological polar surface area (TPSA) of 39.83 Ų, 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium has 0 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 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium?
The CAS number of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium is 7217-76-7.
What is the molecular formula of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium?
The molecular formula of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium is C6H7ClN2O.
What is the molecular weight of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium?
The molecular weight of 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium is 158.02 g/mol.
Where can I buy 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium?
You can request a quote for 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,6-dimethyl-1-oxidopyridazin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.