chempirical

Allylmagnesium chloride

C3H5ClMgCAS 2622-05-1100.83 g/mol

Open in Covalent MOL file
Cl−Mg+
Alkene

Properties

Molecular formula
C3H5ClMg
Molar mass
100.83 g/mol
Exact mass
99.9930 Da
Melting point
350 °C (decomposes)
Boiling point
143–145 °C (at 14 Torr)
logP
-2.37Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
2622-05-1
SMILES
[CH2]C=C.[Cl-].[Mg+]
InChIKey
PLYLAFITHJUEGX-UHFFFAOYSA-M
InChI
InChI=1S/C3H5.ClH.Mg/c1-3-2;;/h3H,1-2H2;1H;/q;;+1/p-1

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

Names and synonyms

5 names
  • Magnesium, chloro-2-propen-1-yl-
  • Magnesium, allylchloro-
  • Magnesium, chloro-2-propenyl-
  • Chloro-2-propen-1-ylmagnesium
  • Allylchloromagnesium

Work with Allylmagnesium 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

Allylmagnesium bromide1730-25-265 % similar Tetraallyltin7393-43-347 % similar Isopropylmagnesium chloride1068-55-937 % similar Ethylmagnesium chloride2386-64-337 % similar Chloroethenylmagnesium3536-96-737 % similar Methylmagnesium chloride676-58-435 % similar Chloro(phenylmethyl)magnesium6921-34-235 % similar Allylpalladium chloride dimer12012-95-232 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook