Quinoline, 4-chloro-, 1-oxide
TL;DR: Quinoline, 4-chloro-, 1-oxide (CAS 4637-59-6) is a chemical compound with molecular formula C9H6ClNO and molecular weight 179.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-oxidoquinolin-1-ium
Also Known As: 4-chloroquinoline 1-oxide, Quinoline, 4-chloro-, 1-oxide, 4-Chloroquinoline-1-oxide, 4-chloro-1-oxidoquinolin-1-ium, 4-chloroquinoline N-oxide
| Molecular Formula | C9H6ClNO |
|---|---|
| Molecular Weight | 179.01 g/mol |
| LogP | 2.1266 |
| Topological Polar Surface Area | 26.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.0138 |
| Heavy Atoms | 12 |
| Complexity | 387.2981 |
Chemical Identifiers
| CAS Number | 4637-59-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=[N+]2[O-])Cl |
Product Overview
Quinoline, 4-chloro-, 1-oxide (CAS 4637-59-6), with molecular formula C9H6ClNO and molecular weight 179.01 g/mol. IUPAC: 4-chloro-1-oxidoquinolin-1-ium.
Chemical Property Profile of Quinoline, 4-chloro-, 1-oxide
Property Insights of Quinoline, 4-chloro-, 1-oxide
The XLogP value of 2.1266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinoline, 4-chloro-, 1-oxide. With a topological polar surface area (TPSA) of 26.94 Ų, Quinoline, 4-chloro-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoline, 4-chloro-, 1-oxide 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 Quinoline, 4-chloro-, 1-oxide?
The CAS number of Quinoline, 4-chloro-, 1-oxide is 4637-59-6.
What is the molecular formula of Quinoline, 4-chloro-, 1-oxide?
The molecular formula of Quinoline, 4-chloro-, 1-oxide is C9H6ClNO.
What is the molecular weight of Quinoline, 4-chloro-, 1-oxide?
The molecular weight of Quinoline, 4-chloro-, 1-oxide is 179.01 g/mol.
Where can I buy Quinoline, 4-chloro-, 1-oxide?
You can request a quote for Quinoline, 4-chloro-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinoline, 4-chloro-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Quinoline, 4-chloro-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.