(E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide
TL;DR: (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide (CAS 104118-89-0) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(4-nitro-1-oxidopyridin-1-ium-3-yl)ethenyl]morpholine
Also Known As: (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide, BAS 00340804, F0017-1084, 3-(4-Morpholinovinylene)-4-nitropyridine 1-oxide, 3-[2-(morpholin-4-yl)ethenyl]-4-nitropyridin-1-ium-1-olate
| Molecular Formula | C11H13N3O4 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 0.5311 |
| Topological Polar Surface Area | 82.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.0906 |
| Heavy Atoms | 18 |
| Complexity | 469.35617 |
Chemical Identifiers
| CAS Number | 104118-89-0 |
|---|---|
| SMILES | C1COCCN1/C=C/C2=C(C=C[N+](=C2)[O-])[N+](=O)[O-] |
Product Overview
(E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide (CAS 104118-89-0), with molecular formula C11H13N3O4 and molecular weight 251.09 g/mol. IUPAC: 4-[(E)-2-(4-nitro-1-oxidopyridin-1-ium-3-yl)ethenyl]morpholine.
Chemical Property Profile of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide
Property Insights of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide
The XLogP value of 0.5311 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide. The TPSA of 82.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide. Following Lipinski's Rule of Five, (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide 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 (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide?
The CAS number of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide is 104118-89-0.
What is the molecular formula of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide?
The molecular formula of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide is C11H13N3O4.
What is the molecular weight of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide?
The molecular weight of (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide is 251.09 g/mol.
Where can I buy (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide?
You can request a quote for (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(2-morpholinovinyl)-4-nitropyridine 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.