6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline
TL;DR: 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline (CAS 6848-16-4) is a chemical compound with molecular formula C12H14ClN and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2,2,4-trimethyl-1H-quinoline
Also Known As: 6-chloro-2,2,4-trimethyl-1,2-dihydroquinoline, 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline, 6-chloro-2,2,4-trimethyl-1H-quinoline, Quinoline,6-chloro-1,2-dihydro-2,2,4-trimethyl-, 2,2,4-Trimethyl-6-chloro-1,2-dihydroquinoline
| Molecular Formula | C12H14ClN |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 207.08148 |
| Heavy Atoms | 14 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 6848-16-4 |
|---|---|
| SMILES | CC1=CC(NC2=C1C=C(C=C2)Cl)(C)C |
| InChIKey | XQGISKQNLSPHNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline (CAS 6848-16-4), with molecular formula C12H14ClN and molecular weight 207.08 g/mol. IUPAC: 6-chloro-2,2,4-trimethyl-1H-quinoline.
Chemical Property Profile of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline
Property Insights of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline
The XLogP value of 3.4 indicates that 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline has 1 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 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline?
The CAS number of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline is 6848-16-4.
What is the molecular formula of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline?
The molecular formula of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline is C12H14ClN.
What is the molecular weight of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline?
The molecular weight of 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline is 207.08 g/mol.
Where can I buy 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline?
You can request a quote for 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-1,2-dihydro-2,2,4-trimethylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.