1-{(2S,3R)-3-[(1Z)-2-Methyl-1-Buten-3-Yn-1-Yl]-2-Oxiranyl}Ethanone
[CAS# 111399-76-9]

Identification

• Name: 1-{(2S,3R)-3-[(1Z)-2-Methyl-1-Buten-3-Yn-1-Yl]-2-Oxiranyl}Ethanone
• Synonyms: 1-((2S,3R)-3-((Z)-2-methylbut-1-en-3-yn-1-yl)oxiran-2-yl)ethanone
• Molecular Formula: C₉H₁₀O₂
• Molecular Weight: 150.17
• CAS Registry Number: 111399-76-9
• SMILES: C/C(=C/[C@@H]1[C@H](O1)C(=O)C)/C#C
• InChI: 1S/C9H10O2/c1-4-6(2)5-8-9(11-8)7(3)10/h1,5,8-9H,2-3H3/b6-5-/t8-,9-/m1/s1
• InChIKey: CROKBQLDNWXMJD-JJKLJZTJSA-N

Properties

• Density: 1.173g/cm³ (Cal.)
• Boiling point: 247.778°C at 760 mmHg (Cal.)
• Flash point: 106.887°C (Cal.)
• Refractive index: 1.582 (Cal.)