1-Benzyl-1,4-dihydronicotinamide
[CAS# 952-92-1]

Identification

• Name: 1-Benzyl-1,4-dihydronicotinamide
• Synonyms: 1-(Benzyl)-4H-Pyridine-3-Carboxamide; Cbmicro_010868; 1,4-Dihydro-N-1-Benzylnicotinamide
• Molecular Formula: C₁₃H₁₄N₂O
• Molecular Weight: 214.27
• CAS Registry Number: 952-92-1
• SMILES: C2=C(CN1C=C(CC=C1)C(N)=O)C=CC=C2
• InChI: 1S/C13H14N2O/c14-13(16)12-7-4-8-15(10-12)9-11-5-2-1-3-6-11/h1-6,8,10H,7,9H2,(H2,14,16)
• InChIKey: CMNUYDSETOTBDE-UHFFFAOYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Melting point: 121°C (Expl.)
• Boiling point: 433.398°C at 760 mmHg (Cal.)
• Flash point: 215.912°C (Cal.)

References

• (1): Motonobu Murakami, Kei Ohkubo, Taku Hasobe, Vito Sgobba, Dirk M. Guldi, Florian Wessendorf, Andreas Hirsch and Shunichi Fukuzumi. Implementation of redox gradients in hydrogen bonded complexes containing N,N-dimethylaniline, flavin and fullerene derivatives, J. Mater. Chem., 2010, 20, 1457.