3-Oxo-3-(3,4,5-Triethoxyphenyl)Propanenitrile
[CAS# 267880-91-1]

Identification

• Name: 3-Oxo-3-(3,4,5-Triethoxyphenyl)Propanenitrile
• Synonyms: 3,4,5-Triethoxybenzoylacetonitrile; 3-oxo-3-(3,4,5-triethoxyphenyl)propanenitrile
• Molecular Formula: C₁₅H₁₉NO₄
• Molecular Weight: 277.32
• CAS Registry Number: 267880-91-1
• SMILES: CCOc1c(cc(cc1OCC)C(=O)CC#N)OCC
• InChI: 1S/C15H19NO4/c1-4-18-13-9-11(12(17)7-8-16)10-14(19-5-2)15(13)20-6-3/h9-10H,4-7H2,1-3H3
• InChIKey: UUEPGPLDFRLKFS-UHFFFAOYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 430.846°C at 760 mmHg (Cal.)
• Flash point: 188.219°C (Cal.)
• Refractive index: 1.504 (Cal.)