Quinaldine, 5,8-dinitro-6-methoxy-
TL;DR: Quinaldine, 5,8-dinitro-6-methoxy- (CAS 61895-33-8) is a chemical compound with molecular formula C11H9N3O5 and molecular weight 263.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-methyl-5,8-dinitroquinoline
Also Known As: 5,8-Dinitro-6-methoxyquinaldine, Quinoline,8-dinitro-, 6-methoxy-2-methyl-5,8-dinitroquinoline, Quinaldine, 5,8-dinitro-6-methoxy-, NCIOpen2_006913
| Molecular Formula | C11H9N3O5 |
|---|---|
| Molecular Weight | 263.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.05423 |
| Heavy Atoms | 19 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 61895-33-8 |
|---|---|
| SMILES | CC1=NC2=C(C=C1)C(=C(C=C2[N+](=O)[O-])OC)[N+](=O)[O-] |
| InChIKey | JGXMWNIVIDLSHR-UHFFFAOYSA-N |
Product Overview
Quinaldine, 5,8-dinitro-6-methoxy- (CAS 61895-33-8), with molecular formula C11H9N3O5 and molecular weight 263.05 g/mol. IUPAC: 6-methoxy-2-methyl-5,8-dinitroquinoline.
Chemical Property Profile of Quinaldine, 5,8-dinitro-6-methoxy-
Property Insights of Quinaldine, 5,8-dinitro-6-methoxy-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinaldine, 5,8-dinitro-6-methoxy-. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinaldine, 5,8-dinitro-6-methoxy-. Following Lipinski's Rule of Five, Quinaldine, 5,8-dinitro-6-methoxy- has 0 hydrogen bond donor(s) and 6 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 Quinaldine, 5,8-dinitro-6-methoxy-?
The CAS number of Quinaldine, 5,8-dinitro-6-methoxy- is 61895-33-8.
What is the molecular formula of Quinaldine, 5,8-dinitro-6-methoxy-?
The molecular formula of Quinaldine, 5,8-dinitro-6-methoxy- is C11H9N3O5.
What is the molecular weight of Quinaldine, 5,8-dinitro-6-methoxy-?
The molecular weight of Quinaldine, 5,8-dinitro-6-methoxy- is 263.05 g/mol.
Where can I buy Quinaldine, 5,8-dinitro-6-methoxy-?
You can request a quote for Quinaldine, 5,8-dinitro-6-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinaldine, 5,8-dinitro-6-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Quinaldine, 5,8-dinitro-6-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.