(E)-2-(3-bromo-4-methoxy-phenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid
[CAS# 869497-70-1]

Identification

• Name: (E)-2-(3-bromo-4-methoxy-phenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoic acid
• Synonyms: Benzeneacetic acid, 3-bromo-4-methoxy-a-[(3,4,5-trimethoxyphenyl)methylene]-, (aE)-
• Molecular Formula: C₁₉H₁₉BrO₆
• Molecular Weight: 423.26
• CAS Registry Number: 869497-70-1
• SMILES: COc1ccc(cc1Br)C(=Cc2cc(c(c(c2)OC)OC)OC)C(=O)O
• InChI: 1S/C19H19BrO6/c1-23-15-6-5-12(10-14(15)20)13(19(21)22)7-11-8-16(24-2)18(26-4)17(9-11)25-3/h5-10H,1-4H3,(H,21,22)/b13-7+
• InChIKey: MOKVILJSQICCCH-NTUHNPAUSA-N

Properties

• Density: 1.414g/cm³ (Cal.)
• Boiling point: 520.57°C at 760 mmHg (Cal.)
• Flash point: 268.631°C (Cal.)
• Refractive index: 1.603 (Cal.)