Home Halogens 5-bromo-2-methyl-1H-pyrimidine-4,6-dione

5-bromo-2-methyl-1H-pyrimidine-4,6-dione

CAS No.:
4722-76-3
Catalog Number:
AG00DI2B
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
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Product Description
Catalog Number:
AG00DI2B
Chemical Name:
5-bromo-2-methyl-1H-pyrimidine-4,6-dione
CAS Number:
4722-76-3
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
MDL Number:
MFCD18427081
IUPAC Name:
5-bromo-4-hydroxy-2-methyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H5BrN2O2/c1-2-7-4(9)3(6)5(10)8-2/h1H3,(H2,7,8,9,10)
InChI Key:
BROYZQSAVGDLBG-UHFFFAOYSA-N
SMILES:
O=c1nc(C)[nH]c(c1Br)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.953g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.011g/mol
Monoisotopic Mass:
203.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties