1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide
TL;DR: 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide (CAS 201290-43-9) is a chemical compound with molecular formula C12H13IN2O and molecular weight 328.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone iodide
Also Known As: 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide, 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone;iodide, 11A-025, 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-iumiodide, 1-[4-(3-methylimidazol-1-yl)phenyl]ethanone Iodide
| Molecular Formula | C12H13IN2O |
|---|---|
| Molecular Weight | 328.01 g/mol |
| LogP | -1.4916 |
| Topological Polar Surface Area | 25.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.00726 |
| Heavy Atoms | 16 |
| Complexity | 487.9748 |
Chemical Identifiers
| CAS Number | 201290-43-9 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2C=C[N+](=C2)C.[I-] |
Product Overview
1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide (CAS 201290-43-9), with molecular formula C12H13IN2O and molecular weight 328.01 g/mol. IUPAC: 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone iodide.
Chemical Property Profile of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide
Property Insights of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide
The XLogP value of -1.4916 indicates that 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 25.88 Ų, 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide 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 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide?
The CAS number of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide is 201290-43-9.
What is the molecular formula of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide?
The molecular formula of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide is C12H13IN2O.
What is the molecular weight of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide?
The molecular weight of 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide is 328.01 g/mol.
Where can I buy 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide?
You can request a quote for 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-acetylphenyl)-3-methyl-1H-imidazol-3-ium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.