sec-Butyllithium

C4H9LiCAS 598-30-164.06 g/mol

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Li+CH−

Properties

Molecular formula
C4H9Li
Molar mass
64.06 g/mol
Exact mass
64.0864 Da
Density
0.783 g/mL (at 25 °C)
logP
1.24Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

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
598-30-1
SMILES
[Li+].CC[CH-]C
InChIKey
WGOPGODQLGJZGL-UHFFFAOYSA-N
InChI
InChI=1S/C4H9.Li/c1-3-4-2;/h3H,4H2,1-2H3;/q-1;+1

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

Names and synonyms

5 names
  • Lithium, (1-methylpropyl)-
  • Lithium, sec-butyl-
  • (1-Methylpropyl)lithium
  • 2-Butyllithium
  • s-Butyllithium

Work with sec-Butyllithium

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

Lithium triethylborohydride22560-16-330 % similar Lithium ethoxide2388-07-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

n-Butyllithium109-72-8 tert-Butyllithium594-19-4 Isobutyllithium920-36-5

Elsewhere

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