Quinoline, 4-nitro-
TL;DR: Quinoline, 4-nitro- (CAS 3741-15-9) is a chemical compound with molecular formula C9H6N2O2 and molecular weight 174.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitroquinoline
Also Known As: 4-Nitroquinoline, Quinoline, 4-nitro-, 5-nitrochinolin, Nitroquinoline, 4-, 5-20-07-00324 (Beilstein Handbook Reference)
| Molecular Formula | C9H6N2O2 |
|---|---|
| Molecular Weight | 174.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.04292 |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 3741-15-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=N2)[N+](=O)[O-] |
| InChIKey | ZPVSFHWMXABGPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinoline, 4-nitro- (CAS 3741-15-9), with molecular formula C9H6N2O2 and molecular weight 174.04 g/mol. IUPAC: 4-nitroquinoline.
Chemical Property Profile of Quinoline, 4-nitro-
Property Insights of Quinoline, 4-nitro-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinoline, 4-nitro-. With a topological polar surface area (TPSA) of 58.7 Ų, Quinoline, 4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoline, 4-nitro- 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 Quinoline, 4-nitro-?
The CAS number of Quinoline, 4-nitro- is 3741-15-9.
What is the molecular formula of Quinoline, 4-nitro-?
The molecular formula of Quinoline, 4-nitro- is C9H6N2O2.
What is the molecular weight of Quinoline, 4-nitro-?
The molecular weight of Quinoline, 4-nitro- is 174.04 g/mol.
Where can I buy Quinoline, 4-nitro-?
You can request a quote for Quinoline, 4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinoline, 4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Quinoline, 4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.