4-Hydroxy-6-(trifluoromethyl)pyrimidine-2-thiol Structure

4-Hydroxy-6-(trifluoromethyl)pyrimidine-2-thiol

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
pka 6.21±0.20(Predicted)
form  Powder
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)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HazardClass  IRRITANT
HS Code  29335990
Storage Class 11 - Combustible Solids
NFPA 704:
1
2 0

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