2-[(2-Ethoxy-2-Oxoethyl)Sulfanyl]Benzenecarboxylic Acid
[CAS# 18926-41-5]

Identification

• Name: 2-[(2-Ethoxy-2-Oxoethyl)Sulfanyl]Benzenecarboxylic Acid
• Synonyms: 2-(2-Ethoxy-2-Oxo-Ethyl)Sulfanylbenzoate; 2-[(2-Ethoxy-2-Oxoethyl)Thio]Benzoate; 2-[(2-Ethoxy-2-Keto-Ethyl)Thio]Benzoate
• Molecular Formula: C₁₁H₁₁O₄S
• Molecular Weight: 239.27
• CAS Registry Number: 18926-41-5
• SMILES: C1=C(SCC(OCC)=O)C(=CC=C1)C([O-])=O
• InChI: 1S/C11H12O4S/c1-2-15-10(12)7-16-9-6-4-3-5-8(9)11(13)14/h3-6H,2,7H2,1H3,(H,13,14)/p-1
• InChIKey: PIYOYRCYHLJDCQ-UHFFFAOYSA-M

Properties

• Boiling point: 370.684°C at 760 mmHg (Cal.)
• Flash point: 177.983°C (Cal.)