chempirical

Hexylmagnesium bromide

C6H13BrMgCAS 3761-92-0189.38 g/mol

Open in Covalent MOL file
Br−Mg+

Properties

Molecular formula
C6H13BrMg
Molar mass
189.38 g/mol
Exact mass
188.0051 Da
logP
-0.98Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
3761-92-0
SMILES
[Br-].[CH2]CCCCC.[Mg+]
InChIKey
SFXUWNMDTWQSHE-UHFFFAOYSA-M
InChI
InChI=1S/C6H13.BrH.Mg/c1-3-5-6-4-2;;/h1,3-6H2,2H3;1H;/q;;+1/p-1

Weigh it out

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

Names and synonyms

3 names
  • Magnesium, bromohexyl-
  • Bromohexylmagnesium
  • 1-Hexylmagnesium bromide

Work with Hexylmagnesium bromide

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

Hexyllithium21369-64-261 % similar Tetraoctylstannane3590-84-958 % similar Dioctyltin dichloride3542-36-758 % similar Trioctyltin chloride2587-76-052 % similar Dioctyltin oxide870-08-652 % similar Bromotributylstannane1461-23-050 % similar Butylmagnesium chloride693-04-950 % similar Propylmagnesium bromide927-77-546 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook