5-Hydroxy-2-pentanone
Properties
- Molecular formula
- C5H10O2
- Molar mass
- 102.13 g/mol
- Exact mass
- 102.0681 Da
- Density
- 1.007 g/mL (at 17 °C)
- Boiling point
- 209 °C
- logP
- 0.35Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Not classified as hazardous under GHS by 74 ECHA notifiers. Aggregated from 74 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Identifiers
CAS number
1071-73-4SMILES
CC(=O)CCCOInChIKey
JSHPTIGHEWEXRW-UHFFFAOYSA-NInChI
InChI=1S/C5H10O2/c1-5(7)3-2-4-6/h6H,2-4H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
11 names
- 2-Pentanone, 5-hydroxy-
- γ-Acetopropanol
- 3-Acetyl-1-propanol
- γ-Acetylpropyl alcohol
- 3-Acetopropanol
- 3-Acetylpropanol
- γ-Acetopropyl alcohol
- 4-Oxo-1-pentanol
- NSC 19158
- NSC 33940
- 5-Hydroxy-n-pentan-2-one
Work with 5-Hydroxy-2-pentanone
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-butanone590-90-971 % similar
2,15-Hexadecanedione18650-13-062 % similar
Hexane-2,5-dione110-13-455 % similar
5-[Ethyl(2-hydroxyethyl)amino]-2-pentanone74509-79-855 % similar
2-Hexanone591-78-654 % similar
5-Oxohexanoic acid3128-06-154 % similar
6-Oxoheptanoic acid3128-07-254 % similar
2-Heptanone110-43-052 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds