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Cyanogen Bromide For Synthesis

CAT: 1442-1032450 100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1442-1032450 100Size:100 mg
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CAS Number
506-68-3
Molecular Formula
BrCN
Molecular Weight
105.92
HSN Code
28539010

Chemical Information

Cyanogen Bromide

Cyanogen bromide is a colorless to white crystalline solid with a penetrating odor. It is slightly soluble in water. It is gradually decomposed by water and very rapidly by acids to give off hydrogen bromide, a flammable and poisonous gas. Contamination with many materials can cause rapid decomposition of the material. It is toxic by inhalation of its vapors or by the hydrogen cyanide from decomposition or by ingestion. Toxic oxides of nitrogen are produced in fire involving this material. It is used in gold extraction, to make other chemicals, and as a fumigant.

CAS Number506-68-3
PubChem CID10476
IUPAC Namecarbononitridic bromide
Molecular FormulaCBrN
Molecular Weight105.92
XLogP1.1
Topological Polar Surface Area23.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count3
Formal Charge0
Complexity31
SMILES
C(#N)Br
InChI
InChI=1S/CBrN/c2-1-3
InChIKey
ATDGTVJJHBUTRL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyanogen Bromide
CAS: 506-68-3
CID: 10476
Formula: CBrN
MW: 105.92
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight105.92
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass104.92141
Monoisotopic Mass104.92141
Topological Polar Surface Area23.8 Ų
Heavy Atom Count3
Formal Charge0
Complexity31.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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