2-Hydroxyisobutyric acid
Properties
- Molecular formula
- C4H8O3
- Molar mass
- 104.10 g/mol
- Exact mass
- 104.0473 Da
- Melting point
- 82.5 °C
- Boiling point
- 212 °C
- logP
- -0.16Crippen estimate
- Polar surface area
- 57.5 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H315 Causes skin irritation53.4% of notifiers
- H318 Causes serious eye damage52.7% of notifiers
- H335 May cause respiratory irritation52.7% of notifiers
Aggregated from 131 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
594-61-6SMILES
CC(C)(O)C(=O)OInChIKey
BWLBGMIXKSTLSX-UHFFFAOYSA-NInChI
InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
17 names · show all
- Propanoic acid, 2-hydroxy-2-methyl-
- Lactic acid, 2-methyl-
- Isobutyric acid, α-hydroxy-
- 2-Hydroxy-2-methylpropanoic acid
- α-Hydroxyisobutyric acid
- 2-Hydroxy-2-methylpropionic acid
- 2-Methyllactic acid
- Hydroxydimethylacetic acid
- Acetonic acid
- α-Hydroxyisobutanoic acid
- α-Hydroxy-α-methylpropanoic acid
- α-HIB
- NSC 402158
- NSC 4505
- 2,2-Dimethylglycolic acid
- Alpha-hydroxyisobutanoic acid
- 2-Hydroxyisobutanoic acid
Work with 2-Hydroxyisobutyric acid
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
Dimethylmalonic acid595-46-052 % similar
Pivalic acid75-98-952 % similar
3-Hydroxy-3-methyl-2-butanone115-22-048 % similar
Bromoisobutyric acid2052-01-946 % similar
2,2-Difluoropropanoic acid373-96-646 % similar
2-Aminoisobutyric acid62-57-746 % similar
2-Fluoroisobutyric acid63812-15-746 % similar
1-Methylcyclopropanecarboxylic acid6914-76-746 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.