1-(4-fluorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}-1-ethanone

Base Information

• Chemical Name: 1-(4-fluorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}-1-ethanone
• CAS No.: 338422-62-1
• Molecular Formula: C13H13FN2O2S
• Molecular Weight: 280.32
• Hs Code.: 2933299090
• European Community (EC) Number: 873-816-5
• ChEMBL ID: CHEMBL1547966
• Mol file: 338422-62-1.mol

Synonyms:338422-62-1;1-(4-fluorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}-1-ethanone;1-(4-Fluorophenyl)-2-((5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl)thio)ethanone;1-(4-fluorophenyl)-2-[5-(hydroxymethyl)-1-methylimidazol-2-yl]sulfanylethanone;1-(4-Fluorophenyl)-2-([5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl)-1-ethanone;Oprea1_554841;MLS001165508;CHEMBL1547966;HMS2851D13;MFCD00215160;AKOS005070498;SMR000549587;CS-0332790;4H-953;4'-Fluoro-2-[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-ylthio]acetophenone;1-(4-Fluorophenyl)-2-((5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl)thio)ethan-1-one;1-(4-fluorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}ethan-1-one

Chemical Property of 1-(4-fluorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}-1-ethanone

Chemical Property:

• Melting Point: 121-123°C
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 280.06817700
• Heavy Atom Count: 19
• Complexity: 311

Purity/Quality:

98%min ^*data from raw suppliers

4'-Fluoro-2-[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-ylthio]acetophenone ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: CN1C(=CN=C1SCC(=O)C2=CC=C(C=C2)F)CO