1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-3,5,5-trimethyl-1-hexanone
[CAS# 898773-02-9]

Identification

• Name: 1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-3,5,5-trimethyl-1-hexanone
• Synonyms: 5-(1,3-Dioxolan-2-yl)-2-thienyl 2,4,4-trimethylpentyl ketone
• Molecular Formula: C₁₆H₂₄O₃S
• Molecular Weight: 296.42
• CAS Registry Number: 898773-02-9
• SMILES: CC(C)(C)CC(C)CC(=O)c1ccc(s1)C2OCCO2
• InChI: 1S/C16H24O3S/c1-11(10-16(2,3)4)9-12(17)13-5-6-14(20-13)15-18-7-8-19-15/h5-6,11,15H,7-10H2,1-4H3
• InChIKey: SLZGLLVCCKGLBO-UHFFFAOYSA-N

Properties

• Density: 1.09g/cm³ (Cal.)
• Boiling point: 415.211°C at 760 mmHg (Cal.)
• Flash point: 204.913°C (Cal.)
• Refractive index: 1.516 (Cal.)