2-[(2S,3S,5R)-3,5-Dimethyl-6-oxotetrahydro-2H-pyran-2-yl]-2-propen-1-yl acetate
[CAS# 781668-07-3]

Identification

• Name: 2-[(2S,3S,5R)-3,5-Dimethyl-6-oxotetrahydro-2H-pyran-2-yl]-2-propen-1-yl acetate
• Synonyms: 2-((2S,3S,5R)-3,5-dimethyl-6-oxotetrahydro-2H-pyran-2-yl)allyl acetate
• Molecular Formula: C₁₂H₁₈O₄
• Molecular Weight: 226.27
• CAS Registry Number: 781668-07-3
• SMILES: C[C@H]1C[C@H](C(=O)O[C@@H]1C(=C)COC(=O)C)C
• InChI: 1S/C12H18O4/c1-7-5-8(2)12(14)16-11(7)9(3)6-15-10(4)13/h7-8,11H,3,5-6H2,1-2,4H3/t7-,8+,11-/m0/s1
• InChIKey: NMZKKYHFLYSCPE-RNSXUZJQSA-N

Properties

• Density: 1.048g/cm³ (Cal.)
• Boiling point: 346.074°C at 760 mmHg (Cal.)
• Flash point: 170.998°C (Cal.)
• Refractive index: 1.455 (Cal.)