Hexyllithium

C6H13LiCAS 21369-64-292.11 g/mol

Open in Covalent MOL file
Li+CH2−

Properties

Molecular formula
C6H13Li
Molar mass
92.11 g/mol
Exact mass
92.1177 Da
logP
2.02Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

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
21369-64-2
SMILES
[Li+].CCCCC[CH2-]
InChIKey
CETVQRFGPOGIQJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H13.Li/c1-3-5-6-4-2;/h1,3-6H2,2H3;/q-1;+1

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

Names and synonyms

5 names
  • Lithium, hexyl-
  • Hexane, lithium complex
  • 1-Hexyllithium
  • n-Hexyllithium
  • 1-Lithiohexane

Work with Hexyllithium

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

Hexane110-54-347 % similar Octane111-65-944 % similar Nonane111-84-244 % similar Dodecane112-40-344 % similar Icosane112-95-844 % similar Undecane1120-21-444 % similar Decane124-18-544 % similar Tetratriacontane14167-59-044 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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