Ethyl [(3-Oxopropyl)Thio]Acetate
[CAS# 94088-65-0]

Identification

• Name: Ethyl [(3-Oxopropyl)Thio]Acetate
• Synonyms: 2-(3-Oxopropylthio)Acetic Acid Ethyl Ester; 2-(3-Ketopropylthio)Acetic Acid Ethyl Ester; Ethyl 2-(3-Oxopropylsulfanyl)Ethanoate
• Molecular Formula: C₇H₁₂O₃S
• Molecular Weight: 176.23
• CAS Registry Number: 94088-65-0
• EINECS: 302-066-9
• SMILES: C(SCCC=O)C(OCC)=O
• InChI: 1S/C7H12O3S/c1-2-10-7(9)6-11-5-3-4-8/h4H,2-3,5-6H2,1H3
• InChIKey: JKLATJRPTDVTHX-UHFFFAOYSA-N

Properties

• Density: 1.109g/cm³ (Cal.)
• Boiling point: 254.003°C at 760 mmHg (Cal.)
• Flash point: 112.545°C (Cal.)