5-(4-chlorophenyl)-4-ethyl-2-methyl-1,2,4-triazole-3-thione

Names

[ CAS No. ]:
110623-26-2

[ Name ]:
5-(4-chlorophenyl)-4-ethyl-2-methyl-1,2,4-triazole-3-thione

Chemical & Physical Properties

[ Density]:
1.29g/cm3

[ Boiling Point ]:
318.1ºC at 760 mmHg

[ Molecular Formula ]:
C11H12ClN3S

[ Molecular Weight ]:
253.75100

[ Flash Point ]:
146.2ºC

[ Exact Mass ]:
253.04400

[ PSA ]:
54.84000

[ LogP ]:
3.29140

[ Vapour Pressure ]:
0.00037mmHg at 25°C

[ Index of Refraction ]:
1.643

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5358825
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-chlorophenyl)-4-ethyl-2-methyl-
CAS REGISTRY NUMBER :
110623-26-2
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H12-Cl-N3-S
MOLECULAR WEIGHT :
253.77

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 31,1253,1988

Related Compounds

  • 2-Hydroxy-5-(5-methylpyrimidin-2-yl)pyridine-4-carboxylic acid
  • 5-Amino-3-bromo-1-(2-methanesulfinylethyl)-4-methyl-1,2-dihydropyridin-2-one
  • 2-Bromo-5-(3-oxomorpholin-4-yl)benzonitrile
  • 3,5-Dibromo-2-(3-oxomorpholin-4-yl)benzaldehyde
  • methyl 5-amino-4-(2-methoxyethyl)-1-(oxan-4-yl)-1H-pyrazole-3-carboxylate
  • 4,4-Difluoro-1-(1-methylcyclopropyl)pentane-1,3-dione
  • 3-(1H-imidazol-1-yl)-2-[(propan-2-yl)amino]butanoic acid
  • methyl 2-(ethylamino)-3-(1H-1,2,4-triazol-1-yl)butanoate
  • 3,3-Difluoro-1-(1-hydroxycyclopentyl)cyclopentane-1-carboxylic acid
  • 3,3-Difluoro-1-(3-hydroxythiolan-3-yl)cyclopentane-1-carboxylic acid
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