Benzyl 3-Methyl-4-Phenyl-1-(p-Tolylsulphonyl)Piperidine-4-Carboxylate
[CAS# 83898-25-3]

Identification

• Name: Benzyl 3-Methyl-4-Phenyl-1-(p-Tolylsulphonyl)Piperidine-4-Carboxylate
• Synonyms: Phenylmethyl 3-Methyl-1-(4-Methylphenyl)Sulfonyl-4-Phenyl-Piperidine-4-Carboxylate; 3-Methyl-1-(4-Methylphenyl)Sulfonyl-4-Phenyl-4-Piperidinecarboxylic Acid Phenylmethyl Ester; 3-Methyl-1-(4-Methylphenyl)Sulfonyl-4-Phenyl-Isonipecotic Acid Benzyl Ester
• Molecular Formula: C₂₇H₂₉NO₄S
• Molecular Weight: 463.59
• CAS Registry Number: 83898-25-3
• EINECS: 281-233-7
• SMILES: C1=CC(=CC=C1[S](=O)(=O)N4CC(C(C(OCC2=CC=CC=C2)=O)(C3=CC=CC=C3)CC4)C)C
• InChI: 1S/C27H29NO4S/c1-21-13-15-25(16-14-21)33(30,31)28-18-17-27(22(2)19-28,24-11-7-4-8-12-24)26(29)32-20-23-9-5-3-6-10-23/h3-16,22H,17-20H2,1-2H3
• InChIKey: BKRKRKJVVVDWKX-UHFFFAOYSA-N

Properties

• Density: 1.214g/cm³ (Cal.)
• Boiling point: 597.538°C at 760 mmHg (Cal.)
• Flash point: 315.18°C (Cal.)