(2E)-3-{4-Hydroxy-3-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-5-(3-methyl-2-buten-1-yl)phenyl}acrylic acid
[CAS# 85819-51-8]

Identification

• Name: (2E)-3-{4-Hydroxy-3-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-5-(3-methyl-2-buten-1-yl)phenyl}acrylic acid
• Synonyms: 2-Propenoic acid, 3-(4-hydroxy-3-(4-hydroxy-3-methyl-2-butenyl)-5-(3-methyl-2-butenyl)phenyl)-, (E,Z)-; Capillartemisin B
• Molecular Formula: C₁₉H₂₄O₄
• Molecular Weight: 316.39
• CAS Registry Number: 85819-51-8
• SMILES: O=C(O)\C=C\c1cc(c(O)c(c1)C/C=C(/C)CO)C\C=C(/C)C
• InChI: 1S/C19H24O4/c1-13(2)4-7-16-10-15(6-9-18(21)22)11-17(19(16)23)8-5-14(3)12-20/h4-6,9-11,20,23H,7-8,12H2,1-3H3,(H,21,22)/b9-6+,14-5-
• InChIKey: HEFPIIHDRLNTDN-ZCVOOGJLSA-N

Properties

• Density: 1.161g/cm³ (Cal.)
• Boiling point: 511.058°C at 760 mmHg (Cal.)
• Flash point: 276.966°C (Cal.)