![2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate structure](/static/products/2633/263385-05-3.webp)
2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate
TL;DR: 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate (CAS 263385-05-3) is a chemical compound with molecular formula C14H9F3N2O5 and molecular weight 342.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-nitrophenyl)-2-[1-oxido-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxyethanone
Also Known As: 2-[2-(3-nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate, 1-(3-nitrophenyl)-2-[1-oxido-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxyethanone, 2-[2-(3-nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridin-1-ium-1-olate
| Molecular Formula | C14H9F3N2O5 |
|---|---|
| Molecular Weight | 342.05 g/mol |
| LogP | 2.5087 |
| Topological Polar Surface Area | 96.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.04636 |
| Heavy Atoms | 24 |
| Complexity | 792.21967 |
Chemical Identifiers
| CAS Number | 263385-05-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC2=[N+](C=C(C=C2)C(F)(F)F)[O-] |
Product Overview
2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate (CAS 263385-05-3), with molecular formula C14H9F3N2O5 and molecular weight 342.05 g/mol. IUPAC: 1-(3-nitrophenyl)-2-[1-oxido-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxyethanone.
Chemical Property Profile of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate
Property Insights of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate
The XLogP value of 2.5087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate. The TPSA of 96.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate. Following Lipinski's Rule of Five, 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate 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 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate?
The CAS number of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate is 263385-05-3.
What is the molecular formula of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate?
The molecular formula of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate is C14H9F3N2O5.
What is the molecular weight of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate?
The molecular weight of 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate is 342.05 g/mol.
Where can I buy 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate?
You can request a quote for 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(3-Nitrophenyl)-2-oxoethoxy]-5-(trifluoromethyl)pyridinium-1-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.