368-54-7

Name 4-HYDROXY-6-(TRIFLUOROMETHYL)PYRIMIDINE-2-THIOL
CAS 368-54-7
Molecular Formula C5H3F3N2OS
MDL Number MFCD00112978
Molecular Weight 196.15
MOL File 368-54-7.mol
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Chemical Properties

Melting point  246-250 °C (lit.)
density  1.63±0.1 g/cm3(Predicted)
storage temp.  Inert atmosphere,Room Temperature
solubility  soluble in Methanol
form  Powder
pka 6.21±0.20(Predicted)
color  White to Almost white
λmax 270nm(MeOH)(lit.)
InChI 1S/C5H3F3N2OS/c6-5(7,8)2-1-3(11)10-4(12)9-2/h1H,(H2,9,10,11,12)
InChIKey YZAOETRYQWFEOY-UHFFFAOYSA-N
SMILES Oc1cc(nc(S)n1)C(F)(F)F
CAS DataBase Reference 368-54-7(CAS DataBase Reference)
NIST Chemistry Reference Uracil, 2-thio-6-(trifluoromethyl)-(368-54-7)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29335990
Storage Class 11 - Combustible Solids

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