N-(2,6-Dimethylphenyl)-1-methylpiperidine-2-carboxamide
[CAS# 96-88-8]

Identification

• Name: N-(2,6-Dimethylphenyl)-1-methylpiperidine-2-carboxamide
• Synonyms: N-(2,6-Dimethylphenyl)-1-Methyl-Piperidine-2-Carboxamide; N-(2,6-Dimethylphenyl)-1-Methyl-2-Piperidinecarboxamide; N-(2,6-Dimethylphenyl)-1-Methyl-Pipecolinamide
• Molecular Formula: C₁₅H₂₂N₂O
• Molecular Weight: 246.35
• CAS Registry Number: 96-88-8 (34811-66-0)
• EINECS: 202-543-0
• SMILES: C1=CC=C(C(=C1C)NC(C2CCCCN2C)=O)C
• InChI: 1S/C15H22N2O/c1-11-7-6-8-12(2)14(11)16-15(18)13-9-4-5-10-17(13)3/h6-8,13H,4-5,9-10H2,1-3H3,(H,16,18)
• InChIKey: INWLQCZOYSRPNW-UHFFFAOYSA-N

Properties

• Density: 1.077g/cm³ (Cal.)
• Boiling point: 383.062°C at 760 mmHg (Cal.)
• Flash point: 185.47°C (Cal.)

References

• (1): Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493