3-Acetyl-4-chloro-8-methoxyquinoline
TL;DR: 3-Acetyl-4-chloro-8-methoxyquinoline (CAS 115607-73-3) is a chemical compound with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-8-methoxyquinolin-3-yl)ethanone
Also Known As: 3-acetyl-4-chloro-8-methoxyquinoline, 1-(4-Chloro-8-methoxy-3-quinolinyl)ethanone, 1-(4-chloro-8-methoxy-quinolin-3-yl)ethanone, 1-(4-Chloro-8-methoxyquinolin-3-yl)ethan-1-one
| Molecular Formula | C12H10ClNO2 |
|---|---|
| Molecular Weight | 235.04 g/mol |
| LogP | 3.0994 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.04001 |
| Heavy Atoms | 16 |
| Complexity | 566.19244 |
Chemical Identifiers
| CAS Number | 115607-73-3 |
|---|---|
| SMILES | CC(=O)C1=CN=C2C(=C1Cl)C=CC=C2OC |
Product Overview
3-Acetyl-4-chloro-8-methoxyquinoline (CAS 115607-73-3), with molecular formula C12H10ClNO2 and molecular weight 235.04 g/mol. IUPAC: 1-(4-chloro-8-methoxyquinolin-3-yl)ethanone.
Chemical Property Profile of 3-Acetyl-4-chloro-8-methoxyquinoline
Property Insights of 3-Acetyl-4-chloro-8-methoxyquinoline
The XLogP value of 3.0994 indicates that 3-Acetyl-4-chloro-8-methoxyquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 3-Acetyl-4-chloro-8-methoxyquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetyl-4-chloro-8-methoxyquinoline has 0 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 3-Acetyl-4-chloro-8-methoxyquinoline?
The CAS number of 3-Acetyl-4-chloro-8-methoxyquinoline is 115607-73-3.
What is the molecular formula of 3-Acetyl-4-chloro-8-methoxyquinoline?
The molecular formula of 3-Acetyl-4-chloro-8-methoxyquinoline is C12H10ClNO2.
What is the molecular weight of 3-Acetyl-4-chloro-8-methoxyquinoline?
The molecular weight of 3-Acetyl-4-chloro-8-methoxyquinoline is 235.04 g/mol.
Where can I buy 3-Acetyl-4-chloro-8-methoxyquinoline?
You can request a quote for 3-Acetyl-4-chloro-8-methoxyquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-4-chloro-8-methoxyquinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-4-chloro-8-methoxyquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.