1-(1H-Pyrrolo[2,3-b]pyridin-5-yl)ethanone
[CAS# 944937-14-8]

Identification

• Name: 1-(1H-Pyrrolo[2,3-b]pyridin-5-yl)ethanone
• Synonyms: 1-(1H-Pyrrolo[2,3-b]pyridin-5-yl)ethanone; 1-(1H-Pyrrolo[2,3-b]pyridin-5-yl)-ethanone; 5-Acetyl-1H-pyrrolo[2,3-b]pyridine
• Molecular Formula: C₉H₈N₂O
• Molecular Weight: 160.17
• CAS Registry Number: 944937-14-8
• SMILES: CC(=O)C1=CN=C2C(=C1)C=CN2
• InChI: 1S/C9H8N2O/c1-6(12)8-4-7-2-3-10-9(7)11-5-8/h2-5H,1H3,(H,10,11)
• InChIKey: NKVUYPVQGPCIJO-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 181-183°C (Expl.)
• Refractive index: 1.658 (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: IRRITANT