Methyl 4-(2-cyano-2-propanyl)-2-ethoxybenzoate
[CAS# 870007-42-4]

Identification

• Name: Methyl 4-(2-cyano-2-propanyl)-2-ethoxybenzoate
• Synonyms: 4-(Cyano-dimethyl-methyl)-2-ethoxy-benzoic acid methyl ester
• Molecular Formula: C₁₄H₁₇NO₃
• Molecular Weight: 247.29
• CAS Registry Number: 870007-42-4
• SMILES: CCOc1cc(ccc1C(=O)OC)C(C)(C)C#N
• InChI: 1S/C14H17NO3/c1-5-18-12-8-10(14(2,3)9-15)6-7-11(12)13(16)17-4/h6-8H,5H2,1-4H3
• InChIKey: UCUDMRGGGWTXKK-UHFFFAOYSA-N

Properties

• Density: 1.085g/cm³ (Cal.)
• Boiling point: 379.348°C at 760 mmHg (Cal.)
• Flash point: 165.934°C (Cal.)
• Refractive index: 1.505 (Cal.)