2,5-Dimethyl-3-thiofuroylfuran

• CAS: 65505-16-0
• Catalog Number: ACM65505160
• Category: Other Products
• Molecular Weight: 222.26
• Molecular Formula: C₁₁H₁₀O₃S
• Synonyms: 3-Furancarbothioic acid
• IUPAC Name: S-(2,5-Dimethylfuran-3-yl) furan-3-carbothioate
• Canonical SMILES: CC1=CC(=C(O1)C)SC(=O)C2=COC=C2
• InChI: InChI=1S/C11H10O3S/c1-7-5-10(8(2)14-7)15-11(12)9-3-4-13-6-9/h3-6H,1-2H3
• InChI Key: QVKDTUVQQAKGEO-UHFFFAOYSA-N
• Boiling Point: 288 °C
• Flash Point: 128 ºC
• Density: 1.270 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; slighty soluble in fat
• Exact Mass: 222.03506535
• Monoisotopic Mass: 222.03506535
• Odor: Cofee-like roasted meat aroma
• Physical State: Liquid
• Topological Polar Surface Area: 68.6 Ų