1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-3,3-dimethyl-1-butanone
[CAS# 898772-86-6]

Identification

• Name: 1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-3,3-dimethyl-1-butanone
• Synonyms: 2,2-Dimethylpropyl 5-(1,3-Dioxolan-2-yl)-2-thienyl ketone
• Molecular Formula: C₁₃H₁₈O₃S
• Molecular Weight: 254.35
• CAS Registry Number: 898772-86-6
• SMILES: CC(C)(C)CC(=O)c1ccc(s1)C2OCCO2
• InChI: 1S/C13H18O3S/c1-13(2,3)8-9(14)10-4-5-11(17-10)12-15-6-7-16-12/h4-5,12H,6-8H2,1-3H3
• InChIKey: MCMSZRGTPPYKDC-UHFFFAOYSA-N

Properties

• Density: 1.145g/cm³ (Cal.)
• Boiling point: 381.984°C at 760 mmHg (Cal.)
• Flash point: 184.817°C (Cal.)
• Refractive index: 1.528 (Cal.)