4-Methylquinolin-1-ium-1-olate
TL;DR: 4-Methylquinolin-1-ium-1-olate (CAS 4053-40-1) is a chemical compound with molecular formula C10H9NO and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1-oxidoquinolin-1-ium
Also Known As: 4-Methylquinoline 1-oxide, Lepidine N-oxide, Lepidine 1-oxide, 4-methyl-1-oxidoquinolin-1-ium, 4-Methylquinoline oxide
| Molecular Formula | C10H9NO |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 25.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.06842 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 4053-40-1 |
|---|---|
| SMILES | CC1=CC=[N+](C2=CC=CC=C12)[O-] |
| InChIKey | BKKKHCJYHYPKBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylquinolin-1-ium-1-olate (CAS 4053-40-1), with molecular formula C10H9NO and molecular weight 159.07 g/mol. IUPAC: 4-methyl-1-oxidoquinolin-1-ium.
Chemical Property Profile of 4-Methylquinolin-1-ium-1-olate
Property Insights of 4-Methylquinolin-1-ium-1-olate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylquinolin-1-ium-1-olate. With a topological polar surface area (TPSA) of 25.5 Ų, 4-Methylquinolin-1-ium-1-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylquinolin-1-ium-1-olate has 0 hydrogen bond donor(s) and 1 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-Methylquinolin-1-ium-1-olate?
The CAS number of 4-Methylquinolin-1-ium-1-olate is 4053-40-1.
What is the molecular formula of 4-Methylquinolin-1-ium-1-olate?
The molecular formula of 4-Methylquinolin-1-ium-1-olate is C10H9NO.
What is the molecular weight of 4-Methylquinolin-1-ium-1-olate?
The molecular weight of 4-Methylquinolin-1-ium-1-olate is 159.07 g/mol.
Where can I buy 4-Methylquinolin-1-ium-1-olate?
You can request a quote for 4-Methylquinolin-1-ium-1-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylquinolin-1-ium-1-olate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylquinolin-1-ium-1-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.