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N-Bromosuccinimide 98% Extrapure

CAT: 1507-51400500Size: 500 mgDry Ice: NoHazardous: No
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CAT#:1507-51400500Size:500 mg
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CAS Number
128-08-5
HSN Code
29251900

Chemical Information

N-bromobutanimide

N-bromosuccinimide is a five-membered cyclic dicarboximide compound having a bromo substituent on the nitrogen atom. It has a role as a reagent. It is a dicarboximide, an organobromine compound and a pyrrolidinone. It is functionally related to a succinimide.

CAS Number128-08-5
PubChem CID67184
IUPAC Name1-bromopyrrolidine-2,5-dione
Molecular FormulaC4H4BrNO2
Molecular Weight177.98
XLogP-0.1
Topological Polar Surface Area37.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity129
SMILES
C1CC(=O)N(C1=O)Br
InChI
InChI=1S/C4H4BrNO2/c5-6-3(7)1-2-4(6)8/h1-2H2
InChIKey
PCLIMKBDDGJMGD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-bromobutanimide
CAS: 128-08-5
CID: 67184
Formula: C4H4BrNO2
MW: 177.98
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight177.98
XLogP3-0.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass176.94254
Monoisotopic Mass176.94254
Topological Polar Surface Area37.4 Ų
Heavy Atom Count8
Formal Charge0
Complexity129
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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