Sodium α-hydroxybutyrate

C₄H₇NaO₃CAS 5094-24-6126.09 g/mol

Open in Covalent MOL file

Alcohol Carboxylic acid

Properties

Molecular formula: C₄H₇NaO₃
Molar mass: 126.09 g/mol
Exact mass: 126.0293 Da
Boiling point: 108 °C
logP: -0.54Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Identifiers

CAS number

5094-24-6

SMILES

CCC(O)C([O-])=O.[Na+]

InChIKey

LLRJPSAHMBXVHL-UHFFFAOYSA-N

InChI

InChI=1S/C4H8O3.Na/c1-2-3(5)4(6)7;/h3,5H,2H2,1H3,(H,6,7);

Weigh it out

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

Names and synonyms

12 names

Butanoic acid, 2-hydroxy-, sodium salt (1:1)
Butyric acid, 2-hydroxy-, monosodium salt
Butanoic acid, 2-hydroxy-, monosodium salt
Sodium 2-hydroxybutyrate
2-Hydroxybutyric acid sodium salt
Sodium 2-hydroxybutanoate
Butyric acid, 2-hydroxy-, monosodium salt, DL-
DL-α-Hydroxybutyric acid sodium salt
Butanoic acid, 2-hydroxy-, monosodium salt, (±)-
Sodium (±)-2-hydroxybutyrate
2-Hydroxybutanoic acid sodium salt
Sodium (DL)-α-hydroxybutyrate

Work with Sodium α-hydroxybutyrate

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

L-Hydroxysuccinic acid disodium salt138-09-058 % similar Sodium malate22798-10-358 % similar Sodium malate676-46-058 % similar Pentanedioic acid, 2-hydroxy-, sodium salt (1:2), (2R)-103404-90-655 % similar Sodium lactate312-85-650 % similar 4-Hydroxy-3-hexanone4984-85-450 % similar Sodium lactate72-17-350 % similar Sodium L-lactate867-56-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Sodium 3-hydroxybutyrate150-83-4 Sodium 3-hydroxybutyrate306-31-0 Gamma oh502-85-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook