4-Pyrimidinamine, 5-bromo-


Chemical Name: 4-Pyrimidinamine, 5-bromo-
CAS Number: 1439-10-7
Product Number: AG007YF7(AGN-PC-0N1IDX)
Synonyms:
MDL No:
Molecular Formula: C4H4BrN3
Molecular Weight: 173.9987

Identification/Properties


Computed Properties
Molecular Weight:
174.001g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
172.959g/mol
Monoisotopic Mass:
172.959g/mol
Topological Polar Surface Area:
51.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
77.7
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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