Isopropyl (2E)-2-(4-Hydroxy-3,5-Dimethoxybenzylidene)-3-Oxobutanoate
[CAS# 491851-35-5]

Identification

• Name: Isopropyl (2E)-2-(4-Hydroxy-3,5-Dimethoxybenzylidene)-3-Oxobutanoate
• Synonyms: Butanoic acid, 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylene]-3-oxo-, 1-methylethyl ester
• Molecular Formula: C₁₆H₂₀O₆
• Molecular Weight: 308.33
• CAS Registry Number: 491851-35-5
• SMILES: COc1cc(cc(OC)c1O)\C=C(/C(C)=O)C(=O)OC(C)C
• InChI: 1S/C16H20O6/c1-9(2)22-16(19)12(10(3)17)6-11-7-13(20-4)15(18)14(8-11)21-5/h6-9,18H,1-5H3/b12-6+
• InChIKey: MVTXHYVGUGXYDT-WUXMJOGZSA-N

Properties

• Density: 1.185g/cm³ (Cal.)
• Boiling point: 440.036°C at 760 mmHg (Cal.)
• Flash point: 155.991°C (Cal.)
• Refractive index: 1.544 (Cal.)