Pyrimidine, 5-chloro-2,4,6-trifluoro-


Chemical Name: Pyrimidine, 5-chloro-2,4,6-trifluoro-
CAS Number: 697-83-6
Product Number: AG003MM7(AGN-PC-0JL96R)
Synonyms:
MDL No:
Molecular Formula: C4ClF3N2
Molecular Weight: 168.5044

Identification/Properties


Properties
BP:
114.5°C
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.439(lit.)
Computed Properties
Molecular Weight:
168.503g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
167.97g/mol
Monoisotopic Mass:
167.97g/mol
Topological Polar Surface Area:
25.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
113
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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