[(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)methyl]malononitrile
[CAS# 771548-71-1]

Identification

• Name: [(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)methyl]malononitrile
• Synonyms: 2-((2,6,6-trimethylcyclohexa-1,3-dien-1-yl)methyl)malononitrile
• Molecular Formula: C₁₃H₁₆N₂
• Molecular Weight: 200.28
• CAS Registry Number: 771548-71-1
• SMILES: CC1=C(C(CC=C1)(C)C)CC(C#N)C#N
• InChI: 1S/C13H16N2/c1-10-5-4-6-13(2,3)12(10)7-11(8-14)9-15/h4-5,11H,6-7H2,1-3H3
• InChIKey: DHXNSCBCWILGIR-UHFFFAOYSA-N

Properties

• Density: 0.976g/cm³ (Cal.)
• Boiling point: 325.025°C at 760 mmHg (Cal.)
• Flash point: 143.315°C (Cal.)
• Refractive index: 1.49 (Cal.)