4-Propanoyl-1H-Pyrrole-2-carboxylic acid
[CAS# 111468-94-1]

Identification

• Name: 4-Propanoyl-1H-Pyrrole-2-carboxylic acid
• Synonyms: 4-(1-Oxopropyl)-1H-Pyrrole-2-Carboxylate; 4-Propionyl-1H-Pyrrole-2-Carboxylate; Zinc03884406
• Molecular Formula: C₈H₈NO₃
• Molecular Weight: 166.16
• CAS Registry Number: 111468-94-1
• SMILES: C1=C([NH]C=C1C(=O)CC)C([O-])=O
• InChI: 1S/C8H9NO3/c1-2-7(10)5-3-6(8(11)12)9-4-5/h3-4,9H,2H2,1H3,(H,11,12)/p-1
• InChIKey: ZCFLLRUDRAKKFL-UHFFFAOYSA-M

Properties

• Boiling point: 415.354°C at 760 mmHg (Cal.)
• Flash point: 204.999°C (Cal.)