591-28-6

Name 4-THIOURACIL
CAS 591-28-6
Molecular Formula C4H4N2OS
MDL Number MFCD00090842
Molecular Weight 128.15
MOL File 591-28-6.mol

Chemical Properties

Appearance yellow powder
Melting point  295 °C (dec.) (lit.)
density  1.368 (estimate)
refractive index  1.7000 (estimate)
storage temp.  Store at -20°C
solubility  1 M NaOH: soluble50mg/mL
form  Powder
pka 5.38±0.20(Predicted)
color  Yellow
Detection Methods HPLC
InChI InChI=1S/C4H4N2OS/c7-4-5-2-1-3(8)6-4/h1-2H,(H2,5,6,7,8)
InChIKey OVONXEQGWXGFJD-UHFFFAOYSA-N
SMILES C1(=O)NC=CC(=S)N1
CAS DataBase Reference 591-28-6(CAS DataBase Reference)

Safety Data

Hazard Codes  Xn
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36:Wear suitable protective clothing .
WGK Germany  3
HS Code  29335990
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Spectrum Detail

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