2-Methoxy-1-Methyl-4-Oxo-2,5-Cyclohexadiene-1-Carbonitrile
[CAS# 212609-26-2]

Identification

• Name: 2-Methoxy-1-Methyl-4-Oxo-2,5-Cyclohexadiene-1-Carbonitrile
• Synonyms: 2-methoxy-1-methyl-4-oxocyclohexa-2,5-dienecarbonitrile
• Molecular Formula: C₉H₉NO₂
• Molecular Weight: 163.17
• CAS Registry Number: 212609-26-2
• SMILES: O=C\1/C=C\C(C#N)(C(/OC)=C/1)C
• InChI: 1S/C9H9NO2/c1-9(6-10)4-3-7(11)5-8(9)12-2/h3-5H,1-2H3
• InChIKey: LMDITFDHZFWQAJ-UHFFFAOYSA-N

Properties

• Density: 1.141g/cm³ (Cal.)
• Boiling point: 351.954°C at 760 mmHg (Cal.)
• Flash point: 153.721°C (Cal.)
• Refractive index: 1.514 (Cal.)