2-Methylbut-3-En-2-Yl (E)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoate
[CAS# 121496-68-2]

Identification

• Name: 2-Methylbut-3-En-2-Yl (E)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoate
• Synonyms: 1,1-Dimethylprop-2-Enyl (E)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoate; (E)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid 1,1-Dimethylprop-2-Enyl Ester; (E)-3-(3,4-Dihydroxyphenyl)Acrylic Acid 1,1-Dimethylprop-2-Enyl Ester
• Molecular Formula: C₁₄H₁₆O₄
• Molecular Weight: 248.28
• CAS Registry Number: 121496-68-2
• SMILES: C1=C(O)C(=CC=C1\C=C\C(OC(C=C)(C)C)=O)O
• InChI: 1S/C14H16O4/c1-4-14(2,3)18-13(17)8-6-10-5-7-11(15)12(16)9-10/h4-9,15-16H,1H2,2-3H3/b8-6+
• InChIKey: YNXBINXRYLBWOT-SOFGYWHQSA-N

Properties

• Density: 1.191g/cm³ (Cal.)
• Boiling point: 402.106°C at 760 mmHg (Cal.)
• Flash point: 149.249°C (Cal.)