2-Methyl-2-propanyl 4-[(2-cyanophenyl)sulfonyl]-1-piperidinecarboxylate
[CAS# 887589-92-6]

Identification

• Name: 2-Methyl-2-propanyl 4-[(2-cyanophenyl)sulfonyl]-1-piperidinecarboxylate
• Synonyms: 1-Piperidinecarboxylic acid, 4-[(2-cyanophenyl)sulfonyl]-, 1,1-dimethylethyl ester; 1-PIPERIDINECARBOXYLICACID, 4-[(2-CYANOPHENYL)SULFONYL]-, 1,1-DIMETHYLETHYL ESTER; 2-Methyl-2-propanyl 4-[(2-cyanophenyl)sulfonyl]-1-piperidinecarboxylate
• Molecular Formula: C₁₇H₂₂N₂O₄S
• Molecular Weight: 350.43
• CAS Registry Number: 887589-92-6
• SMILES: CC(C)(C)OC(=O)N1CCC(CC1)S(=O)(=O)c2ccccc2C#N
• InChI: 1S/C17H22N2O4S/c1-17(2,3)23-16(20)19-10-8-14(9-11-19)24(21,22)15-7-5-4-6-13(15)12-18/h4-7,14H,8-11H2,1-3H3
• InChIKey: NVSHISLFEZMWSB-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 542.5±50.0°C at 760 mmHg (Cal.)
• Flash point: 281.9±30.1°C (Cal.)
• Refractive index: 1.57 (Cal.)