Ethyl 4-(4-Cyanophenyl)-4-Oxobutanoate
[CAS# 25370-40-5]

Identification

• Name: Ethyl 4-(4-Cyanophenyl)-4-Oxobutanoate
• Synonyms: Ethyl-4-(4-cyanophenyl)-4-oxobutyrate
• Molecular Formula: C₁₃H₁₃NO₃
• Molecular Weight: 231.25
• CAS Registry Number: 25370-40-5
• SMILES: N#Cc1ccc(cc1)C(=O)CCC(=O)OCC
• InChI: 1S/C13H13NO3/c1-2-17-13(16)8-7-12(15)11-5-3-10(9-14)4-6-11/h3-6H,2,7-8H2,1H3
• InChIKey: GNGMXDJQYPWFJI-UHFFFAOYSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 396.431°C at 760 mmHg (Cal.)
• Flash point: 173.421°C (Cal.)
• Refractive index: 1.526 (Cal.)