2,4-Di-sec-butyl-7,7-dimethyl-4,6,7,8-tetrahydro-5H-1,3-benzodioxin-5-one
[CAS# 83814-05-5]

Identification

• Name: 2,4-Di-sec-butyl-7,7-dimethyl-4,6,7,8-tetrahydro-5H-1,3-benzodioxin-5-one
• Synonyms: 2,4-di-sec-butyl-7,8-dihydro-7,7-dimethyl-4H-benzo[d][1,3]dioxin-5(6H)-one
• Molecular Formula: C₁₈H₃₀O₃
• Molecular Weight: 294.43
• CAS Registry Number: 83814-05-5
• SMILES: CCC(C)C1C2=C(CC(CC2=O)(C)C)OC(O1)C(C)CC
• InChI: 1S/C18H30O3/c1-7-11(3)16-15-13(19)9-18(5,6)10-14(15)20-17(21-16)12(4)8-2/h11-12,16-17H,7-10H2,1-6H3
• InChIKey: UTLHXQNBCLZCFK-UHFFFAOYSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 390.777°C at 760 mmHg (Cal.)
• Flash point: 181.669°C (Cal.)