(3aS,5aR,6aR,6bS)-4-Bromo-2,2-Dimethyl-3A,5A,6A,6B-Tetrahydrooxireno[E][1,3]Benzodioxole
[CAS# 130669-74-8]

Identification

• Classification: Chemical reagent >> Organic reagent >> Epoxide
• Name: (3aS,5aR,6aR,6bS)-4-Bromo-2,2-Dimethyl-3A,5A,6A,6B-Tetrahydrooxireno[E][1,3]Benzodioxole
• Synonyms: (1R,4S,5S,6R)-3-bromo-4,5-O-isopropylidene-7-oxabicyclo[4.1.0]hept-2-ene-4,5-diol; [3aS-(3aα,5aβ,6aβ,6bα)]-4-Bromo-3a,5a,6a,6b-tetrahydro-2,2-dimethyloxireno[e]-1,3-benzodioxole; [3aS-(3aα,5aβ,6aβ,6bα)]-4-Bromo-3a,5a,6a,6b-tetrahydro-2,2-dimethyloxireno[e]-1,3-benzodioxole
• Molecular Formula: C₉H₁₁BrO₃
• Molecular Weight: 247.09
• CAS Registry Number: 130669-74-8
• SMILES: Br/C2=C/[C@H]1O[C@H]1[C@@H]3OC(O[C@H]23)(C)C
• InChI: 1S/C9H11BrO3/c1-9(2)12-6-4(10)3-5-7(11-5)8(6)13-9/h3,5-8H,1-2H3/t5-,6-,7-,8-/m1/s1
• InChIKey: IJFOOAYHPAECGI-WCTZXXKLSA-N

Properties

• Density: 1.577g/cm³ (Cal.)
• Boiling point: 293.785°C at 760 mmHg (Cal.)
• Flash point: 117.688°C (Cal.)
• Refractive index: 1.55 (Cal.)