2-Hydroxymethylpropenoic Acid [(1aR,4Z,5aR,8aR,9S,10aR,11S)-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# 27470-84-4]

Identification

• Name: 2-Hydroxymethylpropenoic Acid [(1aR,4Z,5aR,8aR,9S,10aR,11S)-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: Hydroxyvernolide
• Molecular Formula: C₁₉H₂₂O₈
• Molecular Weight: 378.38
• CAS Registry Number: 27470-84-4
• SMILES: [C@]134O[C@@H]1CC\C(=C\[C@H]2OC(=O)C([C@@H]2[C@@H](OC(=O)C(CO)=C)C3)=C)CO[C@H]4O
• InChI: 1S/C19H22O8/c1-9(7-20)16(21)26-13-6-19-14(27-19)4-3-11(8-24-18(19)23)5-12-15(13)10(2)17(22)25-12/h5,12-15,18,20,23H,1-4,6-8H2/b11-5-/t12-,13+,14-,15+,18-,19-/m1/s1
• InChIKey: VPZCNCFYAPSUAL-LQLHESBKSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 658.297°C at 760 mmHg (Cal.)
• Flash point: 238.609°C (Cal.)