![1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide structure](/static/products/3173/317377-56-3.webp)
1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide
TL;DR: 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide (CAS 317377-56-3) is a chemical compound with molecular formula C13H11IN2O3 and molecular weight 369.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-nitrophenyl)-2-pyridin-1-ium-1-ylethanone iodide
Also Known As: 1-[2-(3-nitrophenyl)-2-oxoethyl]pyridinium iodide, 1-[2-(3-nitrophenyl)-2-oxoethyl]pyridin-1-ium iodide, 1-(3-nitrophenyl)-2-pyridin-1-ium-1-ylethanone;iodide, 1-2-(3-Nitrophenyl)-2-oxoethylpyridinium iodide, 12E-930
| Molecular Formula | C13H11IN2O3 |
|---|---|
| Molecular Weight | 369.98 g/mol |
| LogP | -1.2308 |
| Topological Polar Surface Area | 64.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.98145 |
| Heavy Atoms | 19 |
| Complexity | 587.452 |
Chemical Identifiers
| CAS Number | 317377-56-3 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-].[I-] |
Product Overview
1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide (CAS 317377-56-3), with molecular formula C13H11IN2O3 and molecular weight 369.98 g/mol. IUPAC: 1-(3-nitrophenyl)-2-pyridin-1-ium-1-ylethanone iodide.
Chemical Property Profile of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide
Property Insights of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide
The XLogP value of -1.2308 indicates that 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide. Following Lipinski's Rule of Five, 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide 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 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide?
The CAS number of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide is 317377-56-3.
What is the molecular formula of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide?
The molecular formula of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide is C13H11IN2O3.
What is the molecular weight of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide?
The molecular weight of 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide is 369.98 g/mol.
Where can I buy 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide?
You can request a quote for 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(3-Nitrophenyl)-2-oxoethyl]pyridinium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.