2-Acetyl-5-methylfuran

• Catalog Number: ACM1193799
• Product Name: 2-Acetyl-5-methylfuran
• CAS: 1193-79-9
• Category: Furans
• Synonyms: 5-Methyl-2-acetylfuran
• IUPAC Name: 1-(5-Methylfuran-2-yl)ethanone
• Molecular Weight: 124.14
• Molecular Formula: C7H8O2
• Canonical SMILES: CC1=CC=C(O1)C(=O)C
• InChI: InChI=1S/C7H8O2/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3
• InChI Key: KEFJLCGVTHRGAH-UHFFFAOYSA-N
• Boiling Point: 100-101 °C
• Melting Point: 2 °C
• Flash Point: 176 °F
• Density: 1.066 g/mL at 25 °C(lit.)
• Solubility: Slightly soluble in water; soluble in alcohol
• Exact Mass: 124.052429494
• Monoisotopic Mass: 124.052429494
• Odor: Strong, nutty, hay-coumarin odor
• Physical State: Liquid
• Refractive Index: n20/D 1.512(lit.)
• Storage Conditions: Inert atmosphere,Room Temperature
• Topological Polar Surface Area: 30.2 Ų