3,6-Dichloro-8-nitroquinoline
TL;DR: 3,6-Dichloro-8-nitroquinoline (CAS 158117-54-5) is a chemical compound with molecular formula C9H4Cl2N2O2 and molecular weight 241.96498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,6-dichloro-8-nitroquinoline
Also Known As: 3,6-dichloro-8-nitroquinoline, 3,6-dichloro-8-nitro-quinoline, NCI60_026030, 3,6-Dichloro-8-(hydroxy(oxido)amino)quinoline
Technical Specifications
| Molecular Formula | C9H4Cl2N2O2 |
| Molecular Weight | 241.96498 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 241.96498 Da |
| Heavy Atoms | 15 |
| Complexity | 259.0 |
| SMILES | C1=C2C=C(C=NC2=C(C=C1Cl)[N+](=O)[O-])Cl |
| InChIKey | HZYKVJJNFZDQPX-UHFFFAOYSA-N |
Chemical Property Profile of 3,6-Dichloro-8-nitroquinoline
Property Insights of 3,6-Dichloro-8-nitroquinoline
The XLogP value of 3.2 indicates that 3,6-Dichloro-8-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, 3,6-Dichloro-8-nitroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dichloro-8-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 3,6-Dichloro-8-nitroquinoline?
The CAS number of 3,6-Dichloro-8-nitroquinoline is 158117-54-5.
What is the molecular formula of 3,6-Dichloro-8-nitroquinoline?
The molecular formula of 3,6-Dichloro-8-nitroquinoline is C9H4Cl2N2O2.
What is the molecular weight of 3,6-Dichloro-8-nitroquinoline?
The molecular weight of 3,6-Dichloro-8-nitroquinoline is 241.96498 g/mol.
Where can I buy 3,6-Dichloro-8-nitroquinoline?
You can request a quote for 3,6-Dichloro-8-nitroquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,6-Dichloro-8-nitroquinoline?
Yes, CoreyChem provides custom synthesis services for 3,6-Dichloro-8-nitroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.