2,4,6-Triethyl-1,3,5-Trioxane
[CAS# 2396-42-1]

Identification

• Name: 2,4,6-Triethyl-1,3,5-Trioxane
• Synonyms: 1,3,5-Trioxane, 2,4,6-Triethyl-; 2,4,6-Triethyl-S-Trioxane; Brn 0106855
• Molecular Formula: C₉H₁₈O₃
• Molecular Weight: 174.24
• CAS Registry Number: 2396-42-1
• SMILES: C(C1OC(OC(O1)CC)CC)C
• InChI: 1S/C9H18O3/c1-4-7-10-8(5-2)12-9(6-3)11-7/h7-9H,4-6H2,1-3H3
• InChIKey: GYBGKXFOKOSPLS-UHFFFAOYSA-N

Properties

• Density: 0.906g/cm³ (Cal.)
• Boiling point: 201.074°C at 760 mmHg (Cal.)
• Flash point: 64.29°C (Cal.)

References

• (1): Simon K. Küster, Ernesto Danieli, Bernhard Blümich and Federico Casanova. High-resolution NMR spectroscopy under the fume hood, Phys. Chem. Chem. Phys., 2011, 13, 13172.