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Trifluorothymine

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Trifluorothymine / CAS : 54-20-6

Appearance White to pale yellow crystalline powder UN -
HS 29335990 DG Class -
Synonyms 5-(Trifluoromethyl)Uracil; 5-Trifluoromethyluracil; 5-(Trifluoromethyl)Pyrimidine-2,4(1H,3H)-Dione
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Properties

Summary

Formula
C5H3F3N2O2
Molecular Mass
180.08500
Exact Mass
180.01500
PSA
65.72000
Logp
0.08200
IUPAC
5-(trifluoromethyl)-1H-pyrimidine-2,4-dione
SMILES
C1=C(C(=O)NC(=O)N1)C(F)(F)F

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Agrochemicals > Pesticide Intermediates

Chemical and Physical Properties

Melting Point
245-246 °C
Density
1.554 g/cm3
Boiling Point
245-246 °C
Appearance
White to pale yellow crystalline powder

Export information

HS Code
29335990
Export Rebate
13%
Risk Code
R22-36/38-40-36/37/38-25
Safety Label
Xi,T

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