Ethyl 2-cyano-3-(6,6-dimethylbicyclo[3.1.1]hept-2-yl)propanoate
[CAS# 85391-87-3]

Identification

• Name: Ethyl 2-cyano-3-(6,6-dimethylbicyclo[3.1.1]hept-2-yl)propanoate
• Synonyms: ethyl α-cyano-6,6-dimethylbicyclo[3.1.1]heptane-2-propionate
• Molecular Formula: C₁₅H₂₃NO₂
• Molecular Weight: 249.35
• CAS Registry Number: 85391-87-3
• EINECS: 286-843-7
• SMILES: CC2(C)C1CC2C(CC1)CC(C#N)C(=O)OCC
• InChI: 1S/C15H23NO2/c1-4-18-14(17)11(9-16)7-10-5-6-12-8-13(10)15(12,2)3/h10-13H,4-8H2,1-3H3
• InChIKey: ZODZFEQFLYGDIG-UHFFFAOYSA-N

Properties

• Density: 1.02g/cm³ (Cal.)
• Boiling point: 351.435°C at 760 mmHg (Cal.)
• Flash point: 167.653°C (Cal.)