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1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole Structure

1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole

Chemical Properties

Melting point 111-114 °C
Boiling point 451.9±55.0 °C(Predicted)
Density  1.17±0.1 g/cm3(Predicted)
storage temp.  Inert atmosphere,2-8°C
pka -1.13±0.11(Predicted)
form  powder to crystal
color  White to Almost white
Sensitive  Moisture Sensitive
InChI InChI=1S/C17H25N3O2S/c1-11(2)14-7-15(12(3)4)17(16(8-14)13(5)6)23(21,22)20-10-18-9-19-20/h7-13H,1-6H3
InChIKey BKJMMUUBRUWPPQ-UHFFFAOYSA-N
SMILES N1(S(C2=C(C(C)C)C=C(C(C)C)C=C2C(C)C)(=O)=O)C=NC=N1
CAS DataBase Reference 54230-60-3(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-37
WGK Germany  3
10-21
HS Code  29339900

MSDS

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