3-Acetyl-2,5-dimethylthiophene

• Catalog Number: ACM2530101
• Product Name: 3-Acetyl-2,5-dimethylthiophene
• CAS: 2530-10-1
• Category: Thiophenes
• Synonyms: 2,5-Dimethyl-3-thienyl methyl ketone
• IUPAC Name: 1-(2,5-Dimethylthiophen-3-yl)ethanone
• Molecular Weight: 154.23
• Molecular Formula: C8H10OS
• Canonical SMILES: CC1=CC(=C(S1)C)C(=O)C
• InChI: InChI=1S/C8H10OS/c1-5-4-8(6(2)9)7(3)10-5/h4H,1-3H3
• InChI Key: PUSJAEJRDNPYKM-UHFFFAOYSA-N
• Boiling Point: 105-108 °C
• Flash Point: 210 °F
• Density: 1.086 g/mL at 25 °C(lit.)
• Solubility: Soluble in alcohol; insoluble in water
• Appearance: Stench Liquid
• Exact Mass: 154.04523611
• Monoisotopic Mass: 154.04523611
• Refractive Index: n20/D 1.544(lit.)
• Topological Polar Surface Area: 45.3 Ų