![3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride structure](/static/products/5315/5315-04-8.webp)
3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride
TL;DR: 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride (CAS 5315-04-8) is a chemical compound with molecular formula C11H10Cl2N2O and molecular weight 256.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride
Also Known As: 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride, 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone;chloride, 1-(4-chlorophenyl)-2-(3H-imidazol-1-yl)ethanone Chloride, 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride, RefChem:1075155
| Molecular Formula | C11H10Cl2N2O |
|---|---|
| Molecular Weight | 256.02 g/mol |
| LogP | -1.1575 |
| Topological Polar Surface Area | 36.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.01703 |
| Heavy Atoms | 16 |
| Complexity | 451.34662 |
Chemical Identifiers
| CAS Number | 5315-04-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C[N+]2=CNC=C2)Cl.[Cl-] |
Product Overview
3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride (CAS 5315-04-8), with molecular formula C11H10Cl2N2O and molecular weight 256.02 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride.
Chemical Property Profile of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride
Property Insights of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride
The XLogP value of -1.1575 indicates that 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.74 Ų, 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride has 1 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 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride?
The CAS number of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride is 5315-04-8.
What is the molecular formula of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride?
The molecular formula of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride is C11H10Cl2N2O.
What is the molecular weight of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride?
The molecular weight of 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride is 256.02 g/mol.
Where can I buy 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride?
You can request a quote for 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-chlorophenyl)-2-oxoethyl]-1H-imidazol-3-ium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.