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Acetyl Bromide 98% For Synthesis

CAT: 1507-4100500Size: 500 mLDry Ice: NoHazardous: No
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CAT#:1507-4100500Size:500 mL
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CAS Number
506-96-7
HSN Code
29159099

Chemical Information

Acetyl bromide

Acetyl bromide appears as a colorless fuming liquid with a pungent odor. Vapors irritate eyes and mucous membranes. Corrosive to metals and tissue. Density 13.9 lb / gal.

CAS Number506-96-7
PubChem CID10482
IUPAC Nameacetyl bromide
Molecular FormulaC2H3BrO
Molecular Weight122.95
XLogP0.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity33
SMILES
CC(=O)Br
InChI
InChI=1S/C2H3BrO/c1-2(3)4/h1H3
InChIKey
FXXACINHVKSMDR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetyl bromide
CAS: 506-96-7
CID: 10482
Formula: C2H3BrO
MW: 122.95
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight122.95
XLogP30.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass121.93673
Monoisotopic Mass121.93673
Topological Polar Surface Area17.1 Ų
Heavy Atom Count4
Formal Charge0
Complexity33
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