Home Halogens Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate

Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate

CAS No.:
71933-03-4
Catalog Number:
AG00FVF3
Molecular Formula:
C6H5BrN2O3
Molecular Weight:
233.0195
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00FVF3
Chemical Name:
Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate
CAS Number:
71933-03-4
Molecular Formula:
C6H5BrN2O3
Molecular Weight:
233.0195
MDL Number:
MFCD09754091
IUPAC Name:
methyl 5-bromo-2-oxo-1H-pyrimidine-6-carboxylate
InChI:
InChI=1S/C6H5BrN2O3/c1-12-5(10)4-3(7)2-8-6(11)9-4/h2H,1H3,(H,8,9,11)
InChI Key:
LQTKGJRZBOYLEY-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(O)ncc1Br
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.948g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.021g/mol
Monoisotopic Mass:
231.948g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties