4-Methyl-5-[4-[(1-Methylethyl)Thio]Phenyl]-3-Octyloxazolidin-2-One
[CAS# 70687-99-9]

Identification

• Name: 4-Methyl-5-[4-[(1-Methylethyl)Thio]Phenyl]-3-Octyloxazolidin-2-One
• Synonyms: 5-(4-Isopropylsulfanylphenyl)-4-Methyl-3-Octyl-Oxazolidin-2-One; 5-[4-(Isopropylthio)Phenyl]-4-Methyl-3-Octyl-2-Oxazolidinone; 5-[4-(Isopropylthio)Phenyl]-4-Methyl-3-Octyl-Oxazolidin-2-One
• Molecular Formula: C₂₁H₃₃NO₂S
• Molecular Weight: 363.56
• CAS Registry Number: 70687-99-9
• EINECS: 274-754-6
• SMILES: C1=CC(=CC=C1SC(C)C)C2OC(=O)N(C2C)CCCCCCCC
• InChI: 1S/C21H33NO2S/c1-5-6-7-8-9-10-15-22-17(4)20(24-21(22)23)18-11-13-19(14-12-18)25-16(2)3/h11-14,16-17,20H,5-10,15H2,1-4H3
• InChIKey: UMRYNDVEINOMAE-UHFFFAOYSA-N

Properties

• Density: 1.065g/cm³ (Cal.)
• Boiling point: 518.359°C at 760 mmHg (Cal.)
• Flash point: 267.294°C (Cal.)