4-[2-(3-Methoxyphenyl)-2-Oxoethyl]Benzonitrile
[CAS# 146653-57-8]

Identification

• Name: 4-[2-(3-Methoxyphenyl)-2-Oxoethyl]Benzonitrile
• Synonyms: ZINC00161870
• Molecular Formula: C₁₆H₁₃NO₂
• Molecular Weight: 251.28
• CAS Registry Number: 146653-57-8
• SMILES: N#Cc1ccc(cc1)CC(=O)c2cc(OC)ccc2
• InChI: 1S/C16H13NO2/c1-19-15-4-2-3-14(10-15)16(18)9-12-5-7-13(11-17)8-6-12/h2-8,10H,9H2,1H3
• InChIKey: IGSPHGYZXBYEMV-UHFFFAOYSA-N

Properties

• Density: 1.185g/cm³ (Cal.)
• Boiling point: 426.267°C at 760 mmHg (Cal.)
• Flash point: 186.272°C (Cal.)
• Refractive index: 1.592 (Cal.)