6-Chloro-2-methylcinnolin-2-ium-4-olate
TL;DR: 6-Chloro-2-methylcinnolin-2-ium-4-olate (CAS 13526-46-0) is a chemical compound with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-methylcinnolin-2-ium-4-olate
Also Known As: 6-chloro-2-methyl-cinnolin-4-olate, 6-chloro-2-methylcinnolin-2-ium-4-olate
| Molecular Formula | C9H7ClN2O |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 0.7863 |
| Topological Polar Surface Area | 39.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.02469 |
| Heavy Atoms | 13 |
| Complexity | 470.36652 |
Chemical Identifiers
| CAS Number | 13526-46-0 |
|---|---|
| SMILES | C[N+]1=NC2=C(C=C(C=C2)Cl)C(=C1)[O-] |
Product Overview
6-Chloro-2-methylcinnolin-2-ium-4-olate (CAS 13526-46-0), with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol. IUPAC: 6-chloro-2-methylcinnolin-2-ium-4-olate.
Chemical Property Profile of 6-Chloro-2-methylcinnolin-2-ium-4-olate
Property Insights of 6-Chloro-2-methylcinnolin-2-ium-4-olate
The XLogP value of 0.7863 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-2-methylcinnolin-2-ium-4-olate. With a topological polar surface area (TPSA) of 39.83 Ų, 6-Chloro-2-methylcinnolin-2-ium-4-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-methylcinnolin-2-ium-4-olate 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 6-Chloro-2-methylcinnolin-2-ium-4-olate?
The CAS number of 6-Chloro-2-methylcinnolin-2-ium-4-olate is 13526-46-0.
What is the molecular formula of 6-Chloro-2-methylcinnolin-2-ium-4-olate?
The molecular formula of 6-Chloro-2-methylcinnolin-2-ium-4-olate is C9H7ClN2O.
What is the molecular weight of 6-Chloro-2-methylcinnolin-2-ium-4-olate?
The molecular weight of 6-Chloro-2-methylcinnolin-2-ium-4-olate is 194.02 g/mol.
Where can I buy 6-Chloro-2-methylcinnolin-2-ium-4-olate?
You can request a quote for 6-Chloro-2-methylcinnolin-2-ium-4-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-methylcinnolin-2-ium-4-olate?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-methylcinnolin-2-ium-4-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.