Hydroxyacetone

C₃H₆O₂CAS 116-09-674.08 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₆O₂
Molar mass: 74.08 g/mol
Exact mass: 74.0368 Da
Density: 1.059 g/mL (at 25 °C)
Melting point: −17 °C
Boiling point: 145.5 °C
logP: -0.43Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H226 Flammable liquid and vapor65.1% of notifiers
H341 Suspected of causing genetic defects16.5% of notifiers

Aggregated from 327 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P318, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

116-09-6

SMILES

CC(=O)CO

InChIKey

XLSMFKSTNGKWQX-UHFFFAOYSA-N

InChI

InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

16 names · show all

2-Propanone, 1-hydroxy-
2-Propanone, hydroxy-
1-Hydroxy-2-propanone
Acetol
Acetone alcohol
Methanol, acetyl-
1-Hydroxyacetone
Hydroxymethyl methyl ketone
Acetylcarbinol
Hydroxypropanone
2-Oxopropanol
α-Hydroxyacetone
Acetylmethanol
Rongal 5242
NSC 102497
1-Hydroxy-2-acetone

Reactions

ACETOL (2-Propanone, 1-hydroxy-)product

Work with Hydroxyacetone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Hydroxy-2-butanone590-90-952 % similar Hexane-2,5-dione110-13-450 % similar Acetylacetone123-54-650 % similar 5-Hydroxy-2-pentanone1071-73-448 % similar Butanone78-93-345 % similar 2,15-Hexadecanedione18650-13-043 % similar Fluoroacetone430-51-343 % similar Bromoacetone598-31-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl formate109-94-4 Reuterin2134-29-4 Glycidol556-52-5 (+)-Glycidol57044-25-4 (-)-Glycidol60456-23-7 Dioxolane646-06-0 Oxetan-3-ol7748-36-9 Propionic acid79-09-4

Elsewhere

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