3-Buten-2-Yl 2-Oxopropanoate
[CAS# 423157-74-8]

Identification

• Name: 3-Buten-2-Yl 2-Oxopropanoate
• Synonyms: but-3-en-2-yl 2-oxopropanoate; InChI=1/C7H10O3/c1-4-5(2)10-7(9)6(3)8/h4-5H,1H2,2-3H3
• Molecular Formula: C₇H₁₀O₃
• Molecular Weight: 142.15
• CAS Registry Number: 423157-74-8
• SMILES: CC(C=C)OC(=O)C(=O)C
• InChI: 1S/C7H10O3/c1-4-5(2)10-7(9)6(3)8/h4-5H,1H2,2-3H3
• InChIKey: ZFUQHIBURURUNI-UHFFFAOYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 180.3±19.0°C at 760 mmHg (Cal.)
• Flash point: 65.6±18.7°C (Cal.)
• Refractive index: 1.427 (Cal.)

References

• (1): Frances Heaney, Julie Fenlon, Colm O'Mahony, Patrick McArdle and Desmond Cunningham. Nitrogen-containing heterocycles: 1,3-dipolar cycloaddition of stabilized nitrones with alkynes; primary cycloadducts, first and second generation rearrangement processes, J. Chem. Soc., Perkin Trans. 1, 2001, 0, 3382.