4-Formyl-1-(2-Propyn-1-Yl)-1H-Pyrrole-2-Carbonitrile
[CAS# 104501-05-5]

Identification

• Name: 4-Formyl-1-(2-Propyn-1-Yl)-1H-Pyrrole-2-Carbonitrile
• Synonyms: 4-formyl-1-(prop-2-yn-1-yl)-1H-pyrrole-2-carbonitrile
• Molecular Formula: C₉H₆N₂O
• Molecular Weight: 158.16
• CAS Registry Number: 104501-05-5
• SMILES: C#CCn1cc(C=O)cc1C#N
• InChI: 1S/C9H6N2O/c1-2-3-11-6-8(7-12)4-9(11)5-10/h1,4,6-7H,3H2
• InChIKey: ARCZLTKZMALRKZ-UHFFFAOYSA-N

Properties

• Density: 1.035g/cm³ (Cal.)
• Boiling point: 268.532°C at 760 mmHg (Cal.)
• Flash point: 116.204°C (Cal.)
• Refractive index: 1.54 (Cal.)