3-Methyl-3-buten-2-one

CAS Name

3-Methyl-3-buten-2-one

Molecular Formula

C₅H₈O

Molecular Mass

84.12

Compound Properties

• Boiling Point (1)

  98 °C

• Melting Point (1)

  -54 °C

• Density (1)

  0.8527 g/cm³ @ Temp: 20 °C

Source(s)

• (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C5H8O/c1-4(2)5(3)6/h1H2,2-3H3

InChIKey

InChIKey=ZGHFDIIVVIFNPS-UHFFFAOYSA-N

SMILES

C(C(C)=O)(C)=C

Canonical SMILES

O=C(C(=C)C)C

Other Names for this Substance