1-(1,1-Dimethylethyl)-4-(Methylthio)-Benzene
[CAS# 7252-86-0]

Identification

• Classification: Chemical reagent >> Organic reagent >> Thiol salt
• Name: 1-(1,1-Dimethylethyl)-4-(Methylthio)-Benzene
• Synonyms: 1-Tert-Butyl-4-Methylsulfanyl-Benzene; 1-Tert-Butyl-4-(Methylthio)Benzene; Nsc73892
• Molecular Formula: C₁₁H₁₆S
• Molecular Weight: 180.31
• CAS Registry Number: 7252-86-0
• SMILES: C1=CC(=CC=C1C(C)(C)C)SC
• InChI: 1S/C11H16S/c1-11(2,3)9-5-7-10(12-4)8-6-9/h5-8H,1-4H3
• InChIKey: JNMLIYFMOVEXEV-UHFFFAOYSA-N

Properties

• Density: 0.968g/cm³ (Cal.)
• Boiling point: 247.29°C at 760 mmHg (Cal.)
• Flash point: 101.524°C (Cal.)