Sodium butoxide

C4H9NaOCAS 2372-45-496.10 g/mol

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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

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
2372-45-4
SMILES
CCCC[O-].[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-Butanol71-36-3Parent compound Aluminum tributoxide3085-30-1Salt

Similar compounds

Pentane109-66-041 % similar Hexane110-54-341 % 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 Octane111-65-939 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sodium tert-butoxide865-48-5

Elsewhere

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