1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime
TL;DR: 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime (CAS 37744-99-3) is a chemical compound with molecular formula C8H8ClF3N2O and molecular weight 240.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trifluoro-1-(1-methylpyridin-1-ium-3-yl)ethylidene]hydroxylamine chloride
Also Known As: 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime
| Molecular Formula | C8H8ClF3N2O |
|---|---|
| Molecular Weight | 240.03 g/mol |
| LogP | -1.7443 |
| Topological Polar Surface Area | 36.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.02773 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 37744-99-3 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)C(=NO)C(F)(F)F.[Cl-] |
| InChIKey | HUNDIQAJSGSWAO-UHFFFAOYSA-N |
Product Overview
1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime (CAS 37744-99-3), with molecular formula C8H8ClF3N2O and molecular weight 240.03 g/mol. IUPAC: N-[2,2,2-trifluoro-1-(1-methylpyridin-1-ium-3-yl)ethylidene]hydroxylamine chloride.
Chemical Property Profile of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime
Property Insights of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime
The XLogP value of -1.7443 indicates that 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.5 Ų, 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime has 1 hydrogen bond donor(s) and 6 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-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime?
The CAS number of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime is 37744-99-3.
What is the molecular formula of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime?
The molecular formula of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime is C8H8ClF3N2O.
What is the molecular weight of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime?
The molecular weight of 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime is 240.03 g/mol.
Where can I buy 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime?
You can request a quote for 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-(trifluoroacetyl)pyridinium chloride oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.