[(5R,6S)-5-[(4R)-2,2-Dimethyl-1,3-Dioxolan-4-Yl]-2,2-Dimethyl-3a,5,6,6a-Tetrahydrofuro[4,5-d][1,3]Dioxol-6-Yl] Butanoate
[CAS# 109984-82-9]

Identification

• Name: [(5R,6S)-5-[(4R)-2,2-Dimethyl-1,3-Dioxolan-4-Yl]-2,2-Dimethyl-3a,5,6,6a-Tetrahydrofuro[4,5-d][1,3]Dioxol-6-Yl] Butanoate
• Synonyms: Butanoic Acid [(5R,6S)-5-[(4R)-2,2-Dimethyl-1,3-Dioxolan-4-Yl]-2,2-Dimethyl-3A,5,6,6A-Tetrahydrofuro[4,5-D][1,3]Dioxol-6-Yl] Ester; Butyric Acid [(5R,6S)-5-[(4R)-2,2-Dimethyl-1,3-Dioxolan-4-Yl]-2,2-Dimethyl-3A,5,6,6A-Tetrahydrofuro[4,5-D][1,3]Dioxol-6-Yl] Ester; 1,2:5,6-Bis-O-(1-Methylethylidene)-Alpha-D-Glucofuranose Butanoate
• Molecular Formula: C₁₆H₂₆O₇
• Molecular Weight: 330.38
• CAS Registry Number: 109984-82-9
• SMILES: [C@@H]2(OC1OC(OC1[C@H]2OC(=O)CCC)(C)C)[C@@H]3OC(OC3)(C)C
• InChI: 1S/C16H26O7/c1-6-7-10(17)19-12-11(9-8-18-15(2,3)21-9)20-14-13(12)22-16(4,5)23-14/h9,11-14H,6-8H2,1-5H3/t9-,11-,12+,13?,14?/m1/s1
• InChIKey: NJJNAEMZQBLYRV-KSDCKGNFSA-N

Properties

• Density: 1.207g/cm³ (Cal.)
• Boiling point: 380.375°C at 760 mmHg (Cal.)
• Flash point: 163.886°C (Cal.)