2-Acetylpyrrole

• CAS: 1072-83-9
• Catalog Number: ACM1072839
• Category: Other Products
• Molecular Weight: 109.13
• Molecular Formula: C₆H₇NO
• Synonyms: 1-(1H-Pyrrol-2-yl)ethan-1-one
• IUPAC Name: 1-(1H-Pyrrol-2-yl)ethanone
• Canonical SMILES: CC(=O)C1=CC=CN1
• InChI: InChI=1S/C6H7NO/c1-5(8)6-3-2-4-7-6/h2-4,7H,1H3
• InChI Key: IGJQUJNPMOYEJY-UHFFFAOYSA-N
• Boiling Point: 220 °C
• Melting Point: 88-93 °C
• Flash Point: 220 °C
• Density: 1.1143 g/mL at 25 °C(lit.)
• Exact Mass: 109.052763847
• Monoisotopic Mass: 109.052763847
• Physical State: Crystalline powder
• Refractive Index: n20/D 1.5040(lit.)
• Storage Conditions: Dry place,Room Temperature
• Topological Polar Surface Area: 32.9 Ų