2-Methylpropenoic Acid [(1aR,4Z,5aR,8aR,9S,10aR,11R)-1A,2,5A,7,8,8A,9,10-Octahydro-11-Hydroxy-8-Methylene-7-Oxo-3H-4,10alpha-(Methanoxymethano)Oxireno[5,6]Cyclodeca[1,2-b]Furan-9-Yl] Ester
[CAS# 27428-86-0]

Identification

• Name: 2-Methylpropenoic Acid [(1aR,4Z,5aR,8aR,9S,10aR,11R)-1A,2,5A,7,8,8A,9,10-Octahydro-11-Hydroxy-8-Methylene-7-Oxo-3H-4,10alpha-(Methanoxymethano)Oxireno[5,6]Cyclodeca[1,2-b]Furan-9-Yl] Ester
• Synonyms: Vernolide
• Molecular Formula: C₁₉H₂₂O₇
• Molecular Weight: 362.38
• CAS Registry Number: 27428-86-0
• SMILES: [C@]134O[C@@H]1CC\C(=C\[C@H]2OC(=O)C([C@@H]2[C@@H](OC(=O)C(C)=C)C3)=C)CO[C@H]4O
• InChI: 1S/C19H22O7/c1-9(2)16(20)25-13-7-19-14(26-19)5-4-11(8-23-18(19)22)6-12-15(13)10(3)17(21)24-12/h6,12-15,18,22H,1,3-5,7-8H2,2H3/b11-6-/t12-,13+,14-,15+,18-,19-/m1/s1
• InChIKey: ZGXVZQZFVYSUDU-ULYHCOEVSA-N

Properties

• Density: 1.349g/cm³ (Cal.)
• Boiling point: 596.393°C at 760 mmHg (Cal.)
• Flash point: 215.983°C (Cal.)