3-Oxobutanol

Molecule SVG Image

Properties Simple | Detailed

Formula C4H8O2
IUPAC Name 4-hydroxybutan-2-one
Molecular Mass 88.105 g·mol−1
Heat of Formation -410.1 ± 16.7 kJ·mol−1
Dipole Moment 1.52 ± 1.08 D
Volume 116.69 Å 3
Surface Area 130.2 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy 3.74 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-butanone, 4-hydroxy-
  • 2-hydroxyethyl methyl ketone
  • 3-ketobutan-1-ol
  • 3-oxo-1-butanol
  • 4-butanol-2-one
  • 4-hydroxy-2-butanone
  • buq
  • ch3c(o)ch2ch2oh
  • ghl.pd_mitscher_leg0.412
  • ketones, c4-6, beta-hydroxy
  • methylolacetone
  • monomethylolacetone
CAS Number(s)
  • 68648-26-0
  • 590-90-9
InChIKey LVSQXDHWDCMMRJ-UHFFFAOYSA-N
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