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

  • 9-cyclopropyl-6-(piperazin-1-yl)-9H-purine
  • 1-(cyclopentylmethyl)-N-[(oxolan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
  • 3-{2-[3-(fluoromethyl)piperidin-1-yl]-2-oxoethyl}-6,7-dimethyl-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
  • 1-[1-(cyclopentylmethyl)-1H-1,2,3-triazole-4-carbonyl]piperidine
  • 1-(5-Chlorothiophene-2-carbonyl)-3-(fluoromethyl)piperidine
  • 1-(2,3-Dihydro-1,4-benzodioxine-5-carbonyl)-4-(fluoromethyl)piperidine
  • 3-{3-[4-(Fluoromethyl)piperidine-1-carbonyl]-1,2-oxazol-5-yl}pyridine
  • 1-(2,3-Dihydro-1,4-benzodioxine-2-carbonyl)-4-(fluoromethyl)piperidine
  • 1-(cyclopentylmethyl)-N-[2-(diethylamino)ethyl]-1H-1,2,3-triazole-4-carboxamide
  • 3-(3,5-dimethyl-1H-pyrazol-1-yl)-6-[4-(fluoromethyl)piperidine-1-carbonyl]pyridazine
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