4,4-Dimethyl-1-oxo-1-(phenylsulfanyl)-2-pentanyl acetate
[CAS# 65302-92-3]

Identification

• Name: 4,4-Dimethyl-1-oxo-1-(phenylsulfanyl)-2-pentanyl acetate
• Synonyms: 2-Acetoxy-3-tert-butyl-S-phenylpropanethioate; 3,3-Dimethyl-1-[(phenylsulfanyl)carbonyl]butyl acetate #
• Molecular Formula: C₁₅H₂₀O₃S
• Molecular Weight: 280.38
• CAS Registry Number: 65302-92-3
• SMILES: O=C(Sc1ccccc1)C(OC(=O)C)CC(C)(C)C
• InChI: 1S/C15H20O3S/c1-11(16)18-13(10-15(2,3)4)14(17)19-12-8-6-5-7-9-12/h5-9,13H,10H2,1-4H3
• InChIKey: UBFVVSIXVRIDRL-UHFFFAOYSA-N

Properties

• Density: 1.108g/cm³ (Cal.)
• Boiling point: 369.045°C at 760 mmHg (Cal.)
• Flash point: 167.232°C (Cal.)