2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride
TL;DR: 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride (CAS 87266-36-2) is a chemical compound with molecular formula C11H11ClN2O and molecular weight 222.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-imidazol-3-ium-3-yl)-1-phenylethanone chloride
Also Known As: 2-(3H-imidazol-1-yl)-1-phenyl-ethanone Chloride, 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride, 2-(1H-imidazol-3-ium-3-yl)-1-phenylethanone chloride, 2-(1H-imidazol-3-ium-3-yl)-1-phenylethanone;chloride
| Molecular Formula | C11H11ClN2O |
|---|---|
| Molecular Weight | 222.06 g/mol |
| LogP | -1.8109 |
| Topological Polar Surface Area | 36.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.05598 |
| Heavy Atoms | 15 |
| Complexity | 411.41766 |
Chemical Identifiers
| CAS Number | 87266-36-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C[N+]2=CNC=C2.[Cl-] |
Product Overview
2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride (CAS 87266-36-2), with molecular formula C11H11ClN2O and molecular weight 222.06 g/mol. IUPAC: 2-(1H-imidazol-3-ium-3-yl)-1-phenylethanone chloride.
Chemical Property Profile of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride
Property Insights of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride
The XLogP value of -1.8109 indicates that 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride 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, 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride 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 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride?
The CAS number of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride is 87266-36-2.
What is the molecular formula of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride?
The molecular formula of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride is C11H11ClN2O.
What is the molecular weight of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride?
The molecular weight of 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride is 222.06 g/mol.
Where can I buy 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride?
You can request a quote for 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-imidazol-1-yl)-1-phenylethanone hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.