33509-43-2

Name 4-Amino-6-(tert-butyl)-3-mercapto-1,2,4-triazin-5(4H)-one
CAS 33509-43-2
EINECS(EC#) 251-548-4
Molecular Formula C7H12N4OS
MDL Number MFCD00225752
Molecular Weight 200.26
MOL File 33509-43-2.mol
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Chemical Properties

Melting point  215 °C(Solv: acetone (67-64-1); toluene (108-88-3))
Boiling point  284.7±23.0 °C(Predicted)
density  1.40±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
solubility  Acetonitrile (Slightly), Chloroform (Slightly)
form  Solid
pka 15.20±0.40(Predicted)
color  White to Off-White
InChI InChI=1S/C7H12N4OS/c1-7(2,3)4-5(12)11(8)6(13)10-9-4/h8H2,1-3H3,(H,10,13)
InChIKey OFKAVNQBCRJBJE-UHFFFAOYSA-N
SMILES N1=C(C(C)(C)C)C(=O)N(N)C(=S)N1
EPA Substance Registry System 1,2,4-Triazin-5(2H)-one, 4-amino-6-(1,1-dimethylethyl)-3,4-dihydro-3-thioxo- (33509-43-2)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P280-P305+P351+P338
Hazard Codes  Xi
Hazard Note  Irritant
TSCA  TSCA listed
HS Code  2933698090

Hazard Information

Spectrum Detail

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