6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium
TL;DR: 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium (CAS 14094-48-5) is a chemical compound with molecular formula C9H4Cl2N2O3 and molecular weight 257.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dichloro-4-nitro-1-oxidoquinolin-1-ium
Also Known As: 6,7-dichloro-4-nitroquinoline1-oxide, 6,7-Dichloro-4-nitroquinoline 1-oxide, Quinoline,6,7-dichloro-4-nitro-, 1-oxide, 6,7-dichloro-4-nitro-1-oxidoquinolin-1-ium, Quinoline, 6,7-dichloro-4-nitro-, 1-oxide
| Molecular Formula | C9H4Cl2N2O3 |
|---|---|
| Molecular Weight | 257.96 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 257.9599 |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 14094-48-5 |
|---|---|
| SMILES | C1=C[N+](=C2C=C(C(=CC2=C1[N+](=O)[O-])Cl)Cl)[O-] |
| InChIKey | WZVIPJLTTWVLHT-UHFFFAOYSA-N |
Product Overview
6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium (CAS 14094-48-5), with molecular formula C9H4Cl2N2O3 and molecular weight 257.96 g/mol. IUPAC: 6,7-dichloro-4-nitro-1-oxidoquinolin-1-ium.
Chemical Property Profile of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium
Property Insights of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium. Following Lipinski's Rule of Five, 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium 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
Frequently Asked Questions
What is the CAS number of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium?
The CAS number of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium is 14094-48-5.
What is the molecular formula of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium?
The molecular formula of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium is C9H4Cl2N2O3.
What is the molecular weight of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium?
The molecular weight of 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium is 257.96 g/mol.
Where can I buy 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium?
You can request a quote for 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dichloro-4-nitro-1-oxidoquinolin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.