4-Chloro-2,8-dimethyl-5-nitroquinoline
TL;DR: 4-Chloro-2,8-dimethyl-5-nitroquinoline (CAS 157493-69-1) is a chemical compound with molecular formula C11H9ClN2O2 and molecular weight 236.03525 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2,8-dimethyl-5-nitroquinoline
Also Known As: 4-chloro-2,8-dimethyl-5-nitroquinoline, 2,8-dimethyl-5-nitro-4-chloroquinoline
Technical Specifications
| Molecular Formula | C11H9ClN2O2 |
| Molecular Weight | 236.03525 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.03525 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | CC1=C2C(=C(C=C1)[N+](=O)[O-])C(=CC(=N2)C)Cl |
| InChIKey | ADJHRRYYNVYIGN-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-2,8-dimethyl-5-nitroquinoline
Property Insights of 4-Chloro-2,8-dimethyl-5-nitroquinoline
The XLogP value of 3.4 indicates that 4-Chloro-2,8-dimethyl-5-nitroquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.7 Ų, 4-Chloro-2,8-dimethyl-5-nitroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2,8-dimethyl-5-nitroquinoline 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
What is the CAS number of 4-Chloro-2,8-dimethyl-5-nitroquinoline?
The CAS number of 4-Chloro-2,8-dimethyl-5-nitroquinoline is 157493-69-1.
What is the molecular formula of 4-Chloro-2,8-dimethyl-5-nitroquinoline?
The molecular formula of 4-Chloro-2,8-dimethyl-5-nitroquinoline is C11H9ClN2O2.
What is the molecular weight of 4-Chloro-2,8-dimethyl-5-nitroquinoline?
The molecular weight of 4-Chloro-2,8-dimethyl-5-nitroquinoline is 236.03525 g/mol.
Where can I buy 4-Chloro-2,8-dimethyl-5-nitroquinoline?
You can request a quote for 4-Chloro-2,8-dimethyl-5-nitroquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-2,8-dimethyl-5-nitroquinoline?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-2,8-dimethyl-5-nitroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.