2-Chloro-3-methylquinoline
TL;DR: 2-Chloro-3-methylquinoline (CAS 57876-69-4) is a chemical compound with molecular formula C10H8ClN and molecular weight 177.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-methylquinoline
Also Known As: 2-chloro-3-methylquinoline, 2-Chloro-3-methyl-quinoline, iomeprol, Cc1cc2ccccc2nc1Cl, zlchem 105
| Molecular Formula | C10H8ClN |
|---|---|
| Molecular Weight | 177.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.03453 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 57876-69-4 |
|---|---|
| SMILES | CC1=CC2=CC=CC=C2N=C1Cl |
| InChIKey | UMYPPRQNLXTIEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-3-methylquinoline (CAS 57876-69-4), with molecular formula C10H8ClN and molecular weight 177.03 g/mol. IUPAC: 2-chloro-3-methylquinoline.
Chemical Property Profile of 2-Chloro-3-methylquinoline
Property Insights of 2-Chloro-3-methylquinoline
The XLogP value of 3.5 indicates that 2-Chloro-3-methylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 2-Chloro-3-methylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3-methylquinoline 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 2-Chloro-3-methylquinoline?
The CAS number of 2-Chloro-3-methylquinoline is 57876-69-4.
What is the molecular formula of 2-Chloro-3-methylquinoline?
The molecular formula of 2-Chloro-3-methylquinoline is C10H8ClN.
What is the molecular weight of 2-Chloro-3-methylquinoline?
The molecular weight of 2-Chloro-3-methylquinoline is 177.03 g/mol.
Where can I buy 2-Chloro-3-methylquinoline?
You can request a quote for 2-Chloro-3-methylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-3-methylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3-methylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.