(S)-2-Hydroxy-3-methylbutanoic acid

C₅H₁₀O₃CAS 17407-55-5118.13 g/mol

Open in Covalent MOL file

Alcohol Carboxylic Acid

Properties

Molecular formula: C₅H₁₀O₃
Molar mass: 118.13 g/mol
Exact mass: 118.0630 Da
Melting point: 71–72 °C
logP: 0.09Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Identifiers

CAS number

17407-55-5

SMILES

CC(C)[C@H](O)C(=O)O

InChIKey

NGEWQZIDQIYUNV-BYPYZUCNSA-N

InChI

InChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)/t4-/m0/s1

Weigh it out

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

Names and synonyms

17 names · show all

Butanoic acid, 2-hydroxy-3-methyl-, (2S)-
Butanoic acid, 2-hydroxy-3-methyl-, (S)-
Butyric acid, 2-hydroxy-3-methyl-, (L)-
(2S)-2-Hydroxy-3-methylbutanoic acid
L-2-Hydroxy-3-methylbutyric acid
L-α-Hydroxyisovaleric acid
L-2-Hydroxyisovaleric acid
(S)-2-Hydroxyisovaleric acid
(S)-α-Hydroxyisovaleric acid
(+)-2-Hydroxy-3-methylbutyric acid
(+)-α-Hydroxyisovaleric acid
(S)-2-Hydroxy-3-methylbutyric acid
(+)-2-Hydroxyisovaleric acid
(S)-(+)-2-Hydroxyisovaleric acid
(S)-(+)-2-Hydroxy-3-methylbutanoic acid
(S)-(+)-2-Hydroxy-3-methylbutyric acid
L-2-Hydroxy-3-methylbutanoic acid

Work with (S)-2-Hydroxy-3-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 Isotope patternExact mass and the mass spectrum pattern

Same formula

Diethyl carbonate105-58-8 Ethylene glycol monomethyl ether acetate110-49-6 Methyl 2-hydroxyisobutyrate2110-78-3 (±)-2-Hydroxy-2-methylbutyric acid3739-30-8 Methyl 3-methoxypropionate3852-09-3 Ethyl 2-methoxyacetate3938-96-3 Methyl (-)-3-hydroxybutyrate3976-69-0 (±)-2-Hydroxyisovaleric acid4026-18-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook