4-(5-Butyl-1,3-dioxan-2-yl)benzonitrile
[CAS# 74240-65-6]

Identification

• Name: 4-(5-Butyl-1,3-dioxan-2-yl)benzonitrile
• Synonyms: 4-(5-Butyl-1,3-dioxan-2-yl)benzonitrile #; trans-4-(5-Butyl-[1,3]dioxan-2-yl)-benzonitrile; trans-4-(5-butyl-1,3-dioxan-2-yl)benzonitrile
• Molecular Formula: C₁₅H₁₉NO₂
• Molecular Weight: 245.32
• CAS Registry Number: 74240-65-6
• SMILES: N#Cc1ccc(cc1)C2OCC(CO2)CCCC
• InChI: 1S/C15H19NO2/c1-2-3-4-13-10-17-15(18-11-13)14-7-5-12(9-16)6-8-14/h5-8,13,15H,2-4,10-11H2,1H3
• InChIKey: ZCZHIMLDHBRGMF-UHFFFAOYSA-N

Properties

• Density: 1.085g/cm³ (Cal.)
• Boiling point: 379.666°C at 760 mmHg (Cal.)
• Flash point: 133.769°C (Cal.)