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Molecule
Vinylmagnesium Bromide
CAS: 1826-67-1 · C2H3BrMg
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 1826-67-1
- Molecular Formula
- C2H3BrMg
- Molecular Mass
- 131.26 g/mol
Identifiers
CAS Registry Number
1826-67-1
SMILES
[Br-].[CH]=C.[Mg+]
InChI Key
XHHHAXOHMKAOSL-UHFFFAOYSA-M
InChI
InChI=1S/C2H3.BrH.Mg/c1-2;;/h1H,2H2;1H;/q;;+1/p-1
Names and Synonyms
- Vinylmagnesium Bromide Synonym
- Magnesium, bromoethenyl- Synonym
- Magnesium, bromovinyl- Synonym
- Vinylmagnesium bromide Synonym
- Bromoethenylmagnesium Synonym
- Norman reagent Synonym
- Bromovinylmagnesium Synonym
- Ethenylmagnesium bromide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 131.26 g/mol | CAS Common Chemistry |
| 131.255 g/mol | RDKit | |
| 134.279 g/mol | chempirical lib | |
| Canonical SMILES | Br[Mg]C=C | CAS Common Chemistry |
| InChI | InChI=1S/C2H3.BrH.Mg/c1-2;;/h1H,2H2;1H;/q;;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=XHHHAXOHMKAOSL-UHFFFAOYSA-M | CAS Common Chemistry |
| Name | Vinylmagnesium bromide | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -2.7714099999999995 | RDKit |
| -2.7714 | RDKit | |
| Molar Refractivity | 15.681000000000001 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 129.926853896 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 131.26 g/mol. Edit any field — others recompute live.
