Acetoin 3D structure

Acetoin (also called 3-hydroxy-2-butanone, 3-hydroxybutan-2-one) has the formula C4H8O2 and a molar mass of 88.11 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C4H8O2
Molar mass
88.11 g/mol
PubChem CID
179
Heavy atoms
6
Category
Food, flavor and fragrance

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name3-hydroxybutan-2-one
SMILESCC(C(=O)C)O
PubChem CID179
Other names3-hydroxy-2-butanone, 3-hydroxybutan-2-one, Dimethylketol, Acetyl methyl carbinol, 2,3-Butanolone

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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