4(3H)-Pyrimidinone, 2,3-diamino-6-(trifluoromethyl)-


Chemical Name: 4(3H)-Pyrimidinone, 2,3-diamino-6-(trifluoromethyl)-
CAS Number: 95095-71-9
Product Number: AG00IIQF(AGN-PC-0K5WQZ)
Synonyms:
MDL No:
Molecular Formula: C5H5F3N4O
Molecular Weight: 194.1146

Identification/Properties


Computed Properties
Molecular Weight:
194.117g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
194.042g/mol
Monoisotopic Mass:
194.042g/mol
Topological Polar Surface Area:
84.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
305
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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