8-Chloro-5,7-dinitroquinoline
TL;DR: 8-Chloro-5,7-dinitroquinoline (CAS 33497-91-5) is a chemical compound with molecular formula C9H4ClN3O4 and molecular weight 252.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-5,7-dinitroquinoline
Also Known As: 8-chloro-5,7-dinitroquinoline, Quinoline, 8-chloro-5,7-dinitro-, 5,7-dinitro-8-chloroquinoline, 8-chloro-5,7-dinitro-quinoline, AMS_CNC_ID-150497967
| Molecular Formula | C9H4ClN3O4 |
|---|---|
| Molecular Weight | 252.99 g/mol |
| LogP | 2.7046 |
| Topological Polar Surface Area | 99.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.98903 |
| Heavy Atoms | 17 |
| Complexity | 643.4187 |
Chemical Identifiers
| CAS Number | 33497-91-5 |
|---|---|
| SMILES | C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])Cl)N=C1 |
Product Overview
8-Chloro-5,7-dinitroquinoline (CAS 33497-91-5), with molecular formula C9H4ClN3O4 and molecular weight 252.99 g/mol. IUPAC: 8-chloro-5,7-dinitroquinoline.
Chemical Property Profile of 8-Chloro-5,7-dinitroquinoline
Property Insights of 8-Chloro-5,7-dinitroquinoline
The XLogP value of 2.7046 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Chloro-5,7-dinitroquinoline. The TPSA of 99.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Chloro-5,7-dinitroquinoline. Following Lipinski's Rule of Five, 8-Chloro-5,7-dinitroquinoline has 0 hydrogen bond donor(s) and 5 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 8-Chloro-5,7-dinitroquinoline?
The CAS number of 8-Chloro-5,7-dinitroquinoline is 33497-91-5.
What is the molecular formula of 8-Chloro-5,7-dinitroquinoline?
The molecular formula of 8-Chloro-5,7-dinitroquinoline is C9H4ClN3O4.
What is the molecular weight of 8-Chloro-5,7-dinitroquinoline?
The molecular weight of 8-Chloro-5,7-dinitroquinoline is 252.99 g/mol.
Where can I buy 8-Chloro-5,7-dinitroquinoline?
You can request a quote for 8-Chloro-5,7-dinitroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Chloro-5,7-dinitroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-Chloro-5,7-dinitroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.