2-Pyrimidinecarboxylic acid, 5-bromo-


Chemical Name: 2-Pyrimidinecarboxylic acid, 5-bromo-
CAS Number: 37131-87-6
Product Number: AG003MKY(AGN-PC-00ZWB4)
Synonyms:
MDL No: MFCD00496793
Molecular Formula: C5H3BrN2O2
Molecular Weight: 202.9935

Identification/Properties


Properties
MP:
197 - 198 °C
BP:
419.7°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
202.995g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
201.938g/mol
Monoisotopic Mass:
201.938g/mol
Topological Polar Surface Area:
63.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
134
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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