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5-Bromo Uracil AR

CAT: 0459-469575-01Size: 1 gDry Ice: NoHazardous: No
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CAS Number
51-20-7

Chemical Information

5-Bromouracil

5-bromouracil is a pyrimidine having keto groups at the 2- and 4-positions and a bromo group at the 5-position. Used mainly as an experimental mutagen. It has a role as a mutagen. It is a member of pyrimidines and a nucleobase analogue. It is functionally related to a uracil.

CAS Number51-20-7
PubChem CID5802
IUPAC Name5-bromo-1H-pyrimidine-2,4-dione
Molecular FormulaC4H3BrN2O2
Molecular Weight190.98
XLogP-0.2
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity199
SMILES
C1=C(C(=O)NC(=O)N1)Br
InChI
InChI=1S/C4H3BrN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
InChIKey
LQLQRFGHAALLLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Bromouracil
CAS: 51-20-7
CID: 5802
Formula: C4H3BrN2O2
MW: 190.98
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight190.98
XLogP3-0.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass189.93779
Monoisotopic Mass189.93779
Topological Polar Surface Area58.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity199
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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Alternative Products

CatalogName
00521 000015-Bromo-Uracil 97% Extrapure
1021490 55-Bromo Uracil Extra Pure
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D26925-015,6-Dihydro-5-bromo-5-methyl uracil
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