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O-Tolylmagnesium bromide solution

CAT: 0024-sc-236220Size: 100 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-236220Size:100 mL
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CAS Number
932-31-0

Chemical Information

Bromo-o-tolylmagnesium
CAS Number932-31-0
PubChem CID101919
IUPAC Namemagnesium;methylbenzene;bromide
Molecular FormulaC7H7BrMg
Molecular Weight195.34
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity145
SMILES
CC1=CC=CC=[C-]1.[Mg+2].[Br-]
InChI
InChI=1S/C7H7.BrH.Mg/c1-7-5-3-2-4-6-7;;/h2-5H,1H3;1H;/q-1;;+2/p-1
InChIKey
YAMQOOCGNXAQGW-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Bromo-o-tolylmagnesium
CAS: 932-31-0
CID: 101919
Formula: C7H7BrMg
MW: 195.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass193.95815
Monoisotopic Mass193.95815
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity145
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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