Pyrimidine, 4-(trifluoromethyl)-


Chemical Name: Pyrimidine, 4-(trifluoromethyl)-
CAS Number: 136547-16-5
Product Number: AG008025(AGN-PC-003NAM)
Synonyms:
MDL No:
Molecular Formula: C5H3F3N2
Molecular Weight: 148.0859

Identification/Properties


Computed Properties
Molecular Weight:
148.088g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
148.025g/mol
Monoisotopic Mass:
148.025g/mol
Topological Polar Surface Area:
25.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
112
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-H320-H335
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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