Isopropyl(Phenethyl) Sulfide
[CAS# 54576-42-0]

Identification

• Name: Isopropyl(Phenethyl) Sulfide
• Synonyms: 2-Isopropylsulfanylethylbenzene; 2-(Isopropylthio)Ethylbenzene; 2-(1-Methylethylthio)Ethylbenzene
• Molecular Formula: C₁₁H₁₆S
• Molecular Weight: 180.31
• CAS Registry Number: 54576-42-0
• SMILES: C1=C(CCSC(C)C)C=CC=C1
• InChI: 1S/C11H16S/c1-10(2)12-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
• InChIKey: MJLYFFRRKQGUDV-UHFFFAOYSA-N

Properties

• Density: 0.969g/cm³ (Cal.)
• Boiling point: 266.022°C at 760 mmHg (Cal.)
• Flash point: 106.594°C (Cal.)