chempirical

2-Methylbutanoic acid

C5H10O2CAS 116-53-0102.13 g/mol

Open in Covalent MOL file
OOH
Carboxylic 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
116-53-0
SMILES
CCC(C)C(=O)O
InChIKey
WLAMNBDJUVNPJU-UHFFFAOYSA-N
InChI
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

Same formula

Ethyl propionate105-37-3 5-Hydroxy-2-pentanone1071-73-4 Isopropyl acetate108-21-4 Valeric acid109-52-4 Propyl acetate109-60-4 Ethylene glycol monoallyl ether111-45-5 4-Methyl-1,3-dioxane1120-97-4 3-Hydroxy-3-methyl-2-butanone115-22-0

Elsewhere

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