4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
TL;DR: 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde (CAS 96600-76-9) is a chemical compound with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-methyl-2-oxoquinoline-3-carbaldehyde
Also Known As: 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde, 4-chloro-1-methyl-2-oxoquinoline-3-carbaldehyde, 6770AC, 4CH-016948, 4-chloro-1-methyl-2-oxo-quinoline-3-carbaldehyde
| Molecular Formula | C11H8ClNO2 |
|---|---|
| Molecular Weight | 221.02 g/mol |
| LogP | 2.0044 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.02435 |
| Heavy Atoms | 15 |
| Complexity | 601.2948 |
Chemical Identifiers
| CAS Number | 96600-76-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C(C1=O)C=O)Cl |
Product Overview
4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde (CAS 96600-76-9), with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol. IUPAC: 4-chloro-1-methyl-2-oxoquinoline-3-carbaldehyde.
Chemical Property Profile of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
Property Insights of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
The XLogP value of 2.0044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde. With a topological polar surface area (TPSA) of 39.07 Ų, 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde 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-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde?
The CAS number of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde is 96600-76-9.
What is the molecular formula of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde?
The molecular formula of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde is C11H8ClNO2.
What is the molecular weight of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde?
The molecular weight of 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde is 221.02 g/mol.
Where can I buy 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde?
You can request a quote for 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.