Ethyl 2-cyano-3-(3,3,7-trimethyltricyclo[5.4.0.0^2,9]undec-8-yl)propanoate
[CAS# 85099-14-5]

Identification

• Name: Ethyl 2-cyano-3-(3,3,7-trimethyltricyclo[5.4.0.0^2,9]undec-8-yl)propanoate
• Synonyms: ethyl α-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate
• Molecular Formula: C₂₀H₃₁NO₂
• Molecular Weight: 317.47
• CAS Registry Number: 85099-14-5
• EINECS: 285-468-6
• SMILES: CCOC(=O)C(C#N)CC2C1CCC3C1C(C)(C)CCCC23C
• InChI: 1S/C20H31NO2/c1-5-23-18(22)13(12-21)11-16-14-7-8-15-17(14)19(2,3)9-6-10-20(15,16)4/h13-17H,5-11H2,1-4H3
• InChIKey: VJKTYQFKYNDHCW-UHFFFAOYSA-N

Properties

• Density: 1.02g/cm³ (Cal.)
• Boiling point: 416.663°C at 760 mmHg (Cal.)
• Flash point: 204.543°C (Cal.)