1,5:2,3-Dianhydro-4,6-O-Benzylidene-D-Allitol
[CAS# 109428-30-0]

Identification

• Name: 1,5:2,3-Dianhydro-4,6-O-Benzylidene-D-Allitol
• Synonyms: (1aS,3aR,7aR,7bS)-6-Phenylhexahydrooxireno[2',3':4,5]pyrano[3,2-d][1,3]dioxine; 1,5:2,3-Dianhydro-4,6-O-benzyliden-D-allitol; 1,5:2,3-Dianhydro-4,6-O-benzylidene-D-allitol
• Molecular Formula: C₁₃H₁₄O₄
• Molecular Weight: 234.25
• CAS Registry Number: 109428-30-0
• SMILES: c1ccc(cc1)C2OC[C@@H]3[C@@H](O2)[C@@H]4[C@@H](O4)CO3
• InChI: 1S/C13H14O4/c1-2-4-8(5-3-1)13-15-6-9-11(17-13)12-10(16-12)7-14-9/h1-5,9-13H,6-7H2/t9-,10+,11-,12+,13?/m1/s1
• InChIKey: BYKNJRIVJRIKQC-UCEQBCCISA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 369.1±37.0°C at 760 mmHg (Cal.)
• Flash point: 156.9±33.3°C (Cal.)
• Refractive index: 1.552 (Cal.)