2-乙基-3-甲基-4-硝基喹啉1-氧化物
TL;DR: 2-乙基-3-甲基-4-硝基喹啉1-氧化物 (CAS 33241-28-0) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙基-3-甲基-4-硝基喹啉1-氧化物
2-ethyl-3-methyl-4-nitro-1-oxidoquinolin-1-ium
Also Known As: 2-Ethyl-3-methyl-4-nitroquinoline 1-oxide, Quinoline, 2-ethyl-3-methyl-4-nitro-, 1-oxide, 2-ethyl-3-methyl-4-nitro-1-oxidoquinolin-1-ium, Quinoline,2-ethyl-3-methyl-4-nitro-,1-oxide, 2-Ethyl-3-methyl-4-nitro-1-oxo-1lambda~5~-quinoline
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 33241-28-0 |
|---|---|
| SMILES | CCC1=[N+](C2=CC=CC=C2C(=C1C)[N+](=O)[O-])[O-] |
| InChIKey | JVPFKNQZFFMUFJ-UHFFFAOYSA-N |
Product Overview
2-乙基-3-甲基-4-硝基喹啉1-氧化物 (CAS 33241-28-0), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 2-ethyl-3-methyl-4-nitro-1-oxidoquinolin-1-ium.
Chemical Property Profile of 2-乙基-3-甲基-4-硝基喹啉1-氧化物
Property Insights of 2-乙基-3-甲基-4-硝基喹啉1-氧化物
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-乙基-3-甲基-4-硝基喹啉1-氧化物. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-乙基-3-甲基-4-硝基喹啉1-氧化物. Following Lipinski's Rule of Five, 2-乙基-3-甲基-4-硝基喹啉1-氧化物 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 2-乙基-3-甲基-4-硝基喹啉1-氧化物?
The CAS number of 2-乙基-3-甲基-4-硝基喹啉1-氧化物 is 33241-28-0.
What is the molecular formula of 2-乙基-3-甲基-4-硝基喹啉1-氧化物?
The molecular formula of 2-乙基-3-甲基-4-硝基喹啉1-氧化物 is C12H12N2O3.
What is the molecular weight of 2-乙基-3-甲基-4-硝基喹啉1-氧化物?
The molecular weight of 2-乙基-3-甲基-4-硝基喹啉1-氧化物 is 232.08 g/mol.
Where can I buy 2-乙基-3-甲基-4-硝基喹啉1-氧化物?
You can request a quote for 2-乙基-3-甲基-4-硝基喹啉1-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙基-3-甲基-4-硝基喹啉1-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 2-乙基-3-甲基-4-硝基喹啉1-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.