45534-08-5

Name 3-AMINO-5-METHYLTHIO-1H-1,2,4-TRIAZOLE
CAS 45534-08-5
EINECS(EC#) 256-242-4
Molecular Formula C3H6N4S
MDL Number MFCD00005232
Molecular Weight 130.17
MOL File 45534-08-5.mol
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Chemical Properties

Appearance white to light beige crystalline powder
Melting point  130-133 °C (lit.)
Boiling point  393.7±25.0 °C(Predicted)
density  1.326 (estimate)
refractive index  1.5605 (estimate)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
form  solid
pka 10.24±0.40(Predicted)
color  White to Almost white
Water Solubility  very faint turbidity
InChI 1S/C3H6N4S/c1-8-3-5-2(4)6-7-3/h1H3,(H3,4,5,6,7)
InChIKey XGWWZKBCQLBJNH-UHFFFAOYSA-N
SMILES CSc1nc(N)n[nH]1
CAS DataBase Reference 45534-08-5(CAS DataBase Reference)
EPA Substance Registry System 1H-1,2,4-Triazol-3-amine, 5-(methylthio)- (45534-08-5)

Safety Data

Hazard Codes  Xn-F
Risk Statements 
R40:Limited evidence of a carcinogenic effect.
R11:Highly Flammable.
Safety Statements 
S36/37:Wear suitable protective clothing and gloves .
S16:Keep away from sources of ignition-No smoking .
RIDADR  2811
WGK Germany  3
TSCA  TSCA listed
HS Code  29339900
Storage Class 11 - Combustible Solids

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