chempirical

Sodium butoxide

C4H9NaOCAS 2372-45-496.10 g/mol

Open in Covalent MOL file
O−Na+
Alcohol

Properties

Molecular formula
C4H9NaO
Molar mass
96.10 g/mol
Exact mass
96.0551 Da
Density
0.86 g/mL
Melting point
−21 °C
logP
0.40Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
2372-45-4
SMILES
CCCC[O-].[Na+]
InChIKey
BDFJWKALVSRGSR-UHFFFAOYSA-N
InChI
InChI=1S/C4H10O.Na/c1-2-3-4-5;/h5H,2-4H2,1H3;

Weigh it out

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

Names and synonyms

8 names
  • 1-Butanol, sodium salt (1:1)
  • Butyl alcohol, sodium salt
  • 1-Butanol, sodium salt
  • Sodium butylate
  • Sodium 1-butoxide
  • Sodium n-butylate
  • Sodium n-butoxide
  • Sodium butanolate

Work with Sodium butoxide

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

Similar compounds

Aluminum tributoxide3085-30-168 % similar Pentane109-66-041 % similar Sodium 1-butanesulfonate2386-54-141 % similar Sodium valerate6106-41-841 % similar Sodium ethoxide141-52-640 % similar Sodium hexanoate10051-44-239 % similar Sodium pentanesulfonate22767-49-339 % similar Decane124-18-539 % similar

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

Same formula

Sodium tert-butoxide865-48-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook