4-Acetyl-1-methylpyridinium
TL;DR: 4-Acetyl-1-methylpyridinium (CAS 45791-64-8) is a chemical compound with molecular formula C8H10NO+ and molecular weight 136.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-methylpyridin-1-ium-4-yl)ethanone
Also Known As: 4-acetyl-1-methylpyridinium, 1-Methyl-4-acetylpyridinium, 4-acetyl-1-methylpyridin-1-ium, 1-(1-methylpyridin-4-yl)ethanone, 1-(1-methylpyridin-1-ium-4-yl)ethanone
| Molecular Formula | C8H10NO+ |
|---|---|
| Molecular Weight | 136.08 g/mol |
| LogP | 0.7137 |
| Topological Polar Surface Area | 20.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.07623 |
| Heavy Atoms | 10 |
| Complexity | 237.93944 |
Chemical Identifiers
| CAS Number | 45791-64-8 |
|---|---|
| SMILES | CC(=O)C1=CC=[N+](C=C1)C |
Product Overview
4-Acetyl-1-methylpyridinium (CAS 45791-64-8), with molecular formula C8H10NO+ and molecular weight 136.08 g/mol. IUPAC: 1-(1-methylpyridin-1-ium-4-yl)ethanone.
Chemical Property Profile of 4-Acetyl-1-methylpyridinium
Property Insights of 4-Acetyl-1-methylpyridinium
The XLogP value of 0.7137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetyl-1-methylpyridinium. With a topological polar surface area (TPSA) of 20.95 Ų, 4-Acetyl-1-methylpyridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Acetyl-1-methylpyridinium has 0 hydrogen bond donor(s) and 1 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 4-Acetyl-1-methylpyridinium?
The CAS number of 4-Acetyl-1-methylpyridinium is 45791-64-8.
What is the molecular formula of 4-Acetyl-1-methylpyridinium?
The molecular formula of 4-Acetyl-1-methylpyridinium is C8H10NO+.
What is the molecular weight of 4-Acetyl-1-methylpyridinium?
The molecular weight of 4-Acetyl-1-methylpyridinium is 136.08 g/mol.
Where can I buy 4-Acetyl-1-methylpyridinium?
You can request a quote for 4-Acetyl-1-methylpyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetyl-1-methylpyridinium?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetyl-1-methylpyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.