2-Methylbutanoic acid
Properties
- Molecular formula
- C5H10O2
- Molar mass
- 102.13 g/mol
- Exact mass
- 102.0681 Da
- Density
- 0.9332 g/mL (at 20 °C)
- Boiling point
- 176.5 °C
- logP
- 1.12Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Identifiers
CAS number
600-07-7SMILES
CCC(C)C(=O)OInChIKey
WLAMNBDJUVNPJU-UHFFFAOYSA-NInChI
InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
20 names · show all
- Butanoic acid, 2-methyl-
- Butyric acid, 2-methyl-
- Butyric acid, α-methyl-
- Active valeric acid
- Ethylmethylacetic acid
- 2-Methylbutyric acid
- α-Methylbutyric acid
- Methylethylacetic acid
- α-Methyl-n-butyric acid
- 2-Methyl-n-butyric acid
- DL-2-Methylbutyric acid
- (±)-2-Methylbutyric acid
- (±)-Methylethylacetic acid
- DL-2-Methylbutanoic acid
- DL-α-Methylbutyric acid
- (±)-2-Methylbutanoic acid
- (±)-α-Methylbutyric acid
- 2-Ethylpropanoic acid
- NSC 7304
- Hydroangelic acid
Work with 2-Methylbutanoic 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
2-Methylbutanoic acid116-53-0100 % similar
(+)-2-Methylbutanoic acid1730-91-2100 % similar
2-Methylvaleric acid97-61-062 % similar
Ethylmalonic acid601-75-258 % similar
2-Ethylbutanoic acid88-09-558 % similar
β-Aminoisobutyric acid10569-72-958 % similar
3-Aminoisobutyric acid144-90-158 % similar
3-Mercaptoisobutyric acid26473-47-258 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds