5-Acetyl-3,5-Dimethyl-1,2,4-Trioxolane-3-Carbonitrile
[CAS# 194021-87-9]

Identification

• Name: 5-Acetyl-3,5-Dimethyl-1,2,4-Trioxolane-3-Carbonitrile
• Synonyms: 5-acetyl-3,5-dimethyl-1,2,4-trioxolane-3-carbonitrile
• Molecular Formula: C₇H₉NO₄
• Molecular Weight: 171.15
• CAS Registry Number: 194021-87-9
• SMILES: O=C(C1(OC(C#N)(OO1)C)C)C
• InChI: 1S/C7H9NO4/c1-5(9)7(3)10-6(2,4-8)11-12-7/h1-3H3
• InChIKey: QAOVTAIRTXPTPY-UHFFFAOYSA-N

Properties

• Density: 1.253g/cm³ (Cal.)
• Boiling point: 268.342°C at 760 mmHg (Cal.)
• Flash point: 114.686°C (Cal.)
• Refractive index: 1.464 (Cal.)