2-Methyl-2-Propanyl [2-(Phenylsulfanyl)Cyclohexyl]Carbamate
[CAS# 359678-99-2]

Identification

• Name: 2-Methyl-2-Propanyl [2-(Phenylsulfanyl)Cyclohexyl]Carbamate
• Synonyms: InChI=1/C17H25NO2S/c1-17(2,3)20-16(19)18-14-11-7-8-12-15(14)21-13-9-5-4-6-10-13/h4-6,9-10,14-15H,7-8,11-12H2,1-3H3,(H,18,19)/f/h18H; tert-butyl (2-(phenylthio)cyclohexyl)carbamate
• Molecular Formula: C₁₇H₂₅NO₂S
• Molecular Weight: 307.45
• CAS Registry Number: 359678-99-2
• SMILES: CC(C)(C)OC(=O)NC1CCCCC1SC2=CC=CC=C2
• InChI: 1S/C17H25NO2S/c1-17(2,3)20-16(19)18-14-11-7-8-12-15(14)21-13-9-5-4-6-10-13/h4-6,9-10,14-15H,7-8,11-12H2,1-3H3,(H,18,19)
• InChIKey: QQENJBNIEGDWOM-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 439.3±34.0°C at 760 mmHg (Cal.)
• Flash point: 219.5±25.7°C (Cal.)
• Refractive index: 1.554 (Cal.)