5-Acetyl-2-(Furfurylthio)Dihydro-2,5-Dimethylfuran-3(2H)-One
[CAS# 67828-71-1]

Identification

• Name: 5-Acetyl-2-(Furfurylthio)Dihydro-2,5-Dimethylfuran-3(2H)-One
• Synonyms: 5-Acetyl-2-(2-Furylmethylsulfanyl)-2,5-Dimethyl-Tetrahydrofuran-3-One; 5-Acetyl-2-(2-Furylmethylthio)-2,5-Dimethyl-3-Tetrahydrofuranone; 5-Acetyl-2-(2-Furylmethylthio)-2,5-Dimethyl-Tetrahydrofuran-3-One
• Molecular Formula: C₁₃H₁₆O₄S
• Molecular Weight: 268.33
• CAS Registry Number: 67828-71-1
• EINECS: 267-290-0
• SMILES: C1=CC=C(O1)CSC2(OC(C(=O)C)(C)CC2=O)C
• InChI: 1S/C13H16O4S/c1-9(14)12(2)7-11(15)13(3,17-12)18-8-10-5-4-6-16-10/h4-6H,7-8H2,1-3H3
• InChIKey: GQCBHHWLIWZIIT-UHFFFAOYSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 395.226°C at 760 mmHg (Cal.)
• Flash point: 192.826°C (Cal.)