tert-Butylmagnesium chloride

C₄H₉ClMgCAS 677-22-5116.87 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₉ClMg
Molar mass: 116.87 g/mol
Exact mass: 116.0243 Da
logP: -1.76Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

677-22-5

SMILES

C[C](C)C.[Cl-].[Mg+]

InChIKey

ZDRJSYVHDMFHSC-UHFFFAOYSA-M

InChI

InChI=1S/C4H9.ClH.Mg/c1-4(2)3;;/h1-3H3;1H;/q;;+1/p-1

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Names and synonyms

6 names

Magnesium, tert-butylchloro-
Magnesium, chloro(1,1-dimethylethyl)-
Chloro(1,1-dimethylethyl)magnesium
tert-Butylchloromagnesium
(1,1-Dimethylethyl)magnesium chloride
t-Butylmagnesium chloride

Work with tert-Butylmagnesium chloride

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

Dichlorobis(1,1-dimethylethyl)stannane19429-30-271 % similar Isopropylmagnesium chloride1068-55-941 % similar Ethylmagnesium chloride2386-64-341 % similar tert-Butyllithium594-19-440 % similar Methylmagnesium chloride676-58-440 % similar Phenylmagnesium chloride100-59-435 % similar [(Trimethylsilyl)methyl]magnesium chloride13170-43-935 % similar Propylmagnesium chloride2234-82-435 % similar

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

Same formula

sec-Butylmagnesium chloride15366-08-2 Butylmagnesium chloride693-04-9

Elsewhere

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