1‐Acetoxy‐1,3‐butadiene
2007
[1515-76-0] C6H8O2 (MW 112.13)
InChI = 1S/C6H8O2/c1-3-4-5-8-6(2)7/h3-5H,1H2,2H3
InChIKey = NMQQBXHZBNUXGJ-UHFFFAOYSA-N
(2π or 4π partner in cycloaddition reactions;1 mono-oxygenation allows high levels of regiocontrol2)
Alternate Name: 1,3-butadienyl acetate.
Physical Data: bp 60–61 °C/40 mmHg; d 0.945 g cm−3.
Form Supplied in: colorless liquid, available as an unspecified mixture of (E) and (Z) isomers.3
Handling, Storage, and Precautions: classified as a flammable liquid and is reputed to be toxic. Compound polymerizes upon extended storage and can be regenerated by distillation. Avoid polymerization initiators. Diene performs best when stored in the cold.
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