Basic information Safety Supplier Related

4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL

Basic information Safety Supplier Related

4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL Basic information

Product Name:
4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL
Synonyms:
  • 4-Methyl-5-(4-pyridinyl)-2H-1,2,4-triazole-3(4H)-thione
  • 4-methyl-5-(4-pyridyl)-2H-1,2,4-triazole-3-thione
  • 4-methyl-5-pyridin-4-yl-2H-1,2,4-triazole-3-thione
  • ART-CHEM-BB B015867
  • BUTTPARK 25\07-10
  • AKOS B015867
  • AKOS BBS-00000624
  • 4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL
CAS:
3652-32-2
MF:
C8H8N4S
MW:
192.24
Product Categories:
  • Pyrazoles & Triazoles
  • Pyrazoles & Triazoles
Mol File:
3652-32-2.mol
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4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL Chemical Properties

Melting point:
287 °C
Boiling point:
294.6±32.0 °C(Predicted)
Density 
1.40±0.1 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
form 
solid
pka
8.18±0.20(Predicted)
color 
Off-white/faint yellow
InChI
InChI=1S/C8H8N4S/c1-12-7(10-11-8(12)13)6-2-4-9-5-3-6/h2-5H,1H3,(H,11,13)
InChIKey
ACDUEIIMRXEFHO-UHFFFAOYSA-N
SMILES
N1=C(C2C=CN=CC=2)N(C)C(=S)N1
CAS DataBase Reference
3652-32-2(CAS DataBase Reference)
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Safety Information

Hazard Codes 
Xi
HazardClass 
IRRITANT
HS Code 
2933998090
Toxicity
mouse,LD50,oral,1100mg/kg (1100mg/kg),Journal of Medicinal Chemistry. Vol. 8, Pg. 676, 1965.

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