(1S,5R)-3-Ethynyl-5-hydroxy-2-methyl-2-cyclohexen-1-yl vinyl carbonate
[CAS# 797037-94-6]

Identification

• Name: (1S,5R)-3-Ethynyl-5-hydroxy-2-methyl-2-cyclohexen-1-yl vinyl carbonate
• Synonyms: (1S,5R)-3-ethynyl-5-hydroxy-2-methylcyclohex-2-en-1-yl vinyl carbonate
• Molecular Formula: C₁₂H₁₄O₄
• Molecular Weight: 222.24
• CAS Registry Number: 797037-94-6
• SMILES: O[C@@H]1C/C(C#C)=C(/C)[C@@H](OC(=O)O\C=C)C1
• InChI: 1S/C12H14O4/c1-4-9-6-10(13)7-11(8(9)3)16-12(14)15-5-2/h1,5,10-11,13H,2,6-7H2,3H3/t10-,11+/m1/s1
• InChIKey: YFXQCFXDWCTETF-MNOVXSKESA-N

Properties

• Density: 1.172g/cm³ (Cal.)
• Boiling point: 340.605°C at 760 mmHg (Cal.)
• Flash point: 127.567°C (Cal.)
• Refractive index: 1.52 (Cal.)