85019-63-2

Basic information

• Product Name: N-benzyl-N-[6-(2-cyanoethyl)cyclohex-1-en-1-yl]butanamide
• CAS NO: 85019-63-2
• Molecular Formula: C₂₀H₂₆N₂O
• Molecular Weight: 310.4332
• Mol File: 85019-63-2.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 518.3°C at 760 mmHg
• Flash Point: 267.2°C
• Density: 1.06g/cm³
• Vapor Pressure: 7.59E-11mmHg at 25°C
• Refractive Index: 1.552
• CAS DataBase Reference: N-benzyl-N-[6-(2-cyanoethyl)cyclohex-1-en-1-yl]butanamide(CAS DataBase Reference)
• NIST Chemistry Reference: N-benzyl-N-[6-(2-cyanoethyl)cyclohex-1-en-1-yl]butanamide(85019-63-2)
• EPA Substance Registry System: N-benzyl-N-[6-(2-cyanoethyl)cyclohex-1-en-1-yl]butanamide(85019-63-2)

Safety Data

• Hazardous Substances Data: 85019-63-2(Hazardous Substances Data)

Upstream product

• 85019-68-7 N-Benzyl-N-[2-(2-cyano-ethyl)-cyclohex-1-enyl]-butyramide 
• 85019-66-5 1-benzylimino-2-(β-cyanoethyl)cyclohexane 
• 141-75-3 butyryl chloride 

Relevant articles and documents

ENAMINE-ENAMINE ISOMERISM IN THE SERIES OF PRODUCTS FROM N-ACYLATION OF N-BENZYL-2-(β-CYANOETHYL)CYCLOHEXANIMINE

The equilibrium between the enamine forms with the trisubstituted and tetrasubstituted double bonds in the products from N-acylation of N-benzyl-2-(β-cyanoethyl)cyclohexanimine was investigated by PMR spectroscopy.The isomerization process is characterized by positive values for the changes in enthalpy and entropy.The two enamine forms exist in the chiral conformations, where the substituents at the nitrogen atom do not lie in the plane of the C=C bond.The free energy of activation for rotation about the Csp2-N bond in the enamine forms with trisubstituted and tetrasubstituted double bonds was determined.