2-Methyl-1-(2-oxopropyl)pyridinium bromide
TL;DR: 2-Methyl-1-(2-oxopropyl)pyridinium bromide (CAS 75487-74-0) is a chemical compound with molecular formula C9H12BrNO and molecular weight 229.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylpyridin-1-ium-1-yl)propan-2-one bromide
Also Known As: 1-(2-methylpyridyl)acetone, bromide, 2-Methyl-1-(2-oxopropyl)pyridinium bromide, 2-methyl-1-(2-oxopropyl)pyridin-1-ium bromide, Pyridinium, 2-methyl-1-(2-oxopropyl)-, bromide, 1-(6-methylpyridin-1-yl)propan-2-one Bromide
| Molecular Formula | C9H12BrNO |
|---|---|
| Molecular Weight | 229.01 g/mol |
| LogP | -2.12448 |
| Topological Polar Surface Area | 20.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.01022 |
| Heavy Atoms | 12 |
| Complexity | 272.98596 |
Chemical Identifiers
| CAS Number | 75487-74-0 |
|---|---|
| SMILES | CC1=CC=CC=[N+]1CC(=O)C.[Br-] |
Product Overview
2-Methyl-1-(2-oxopropyl)pyridinium bromide (CAS 75487-74-0), with molecular formula C9H12BrNO and molecular weight 229.01 g/mol. IUPAC: 1-(2-methylpyridin-1-ium-1-yl)propan-2-one bromide.
Chemical Property Profile of 2-Methyl-1-(2-oxopropyl)pyridinium bromide
Property Insights of 2-Methyl-1-(2-oxopropyl)pyridinium bromide
The XLogP value of -2.12448 indicates that 2-Methyl-1-(2-oxopropyl)pyridinium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.95 Ų, 2-Methyl-1-(2-oxopropyl)pyridinium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-(2-oxopropyl)pyridinium bromide 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 2-Methyl-1-(2-oxopropyl)pyridinium bromide?
The CAS number of 2-Methyl-1-(2-oxopropyl)pyridinium bromide is 75487-74-0.
What is the molecular formula of 2-Methyl-1-(2-oxopropyl)pyridinium bromide?
The molecular formula of 2-Methyl-1-(2-oxopropyl)pyridinium bromide is C9H12BrNO.
What is the molecular weight of 2-Methyl-1-(2-oxopropyl)pyridinium bromide?
The molecular weight of 2-Methyl-1-(2-oxopropyl)pyridinium bromide is 229.01 g/mol.
Where can I buy 2-Methyl-1-(2-oxopropyl)pyridinium bromide?
You can request a quote for 2-Methyl-1-(2-oxopropyl)pyridinium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-(2-oxopropyl)pyridinium bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-(2-oxopropyl)pyridinium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.