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

Names

[ CAS No. ]:
110623-27-3

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

Chemical & Physical Properties

[ Density]:
1.26g/cm3

[ Boiling Point ]:
333.7ºC at 760mmHg

[ Molecular Formula ]:
C12H14ClN3S

[ Molecular Weight ]:
267.77800

[ Flash Point ]:
155.6ºC

[ Exact Mass ]:
267.06000

[ PSA ]:
54.84000

[ LogP ]:
3.68150

[ Vapour Pressure ]:
0.000134mmHg at 25°C

[ Index of Refraction ]:
1.63

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5359055
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-chlorophenyl)-2-methyl-4-propyl-
CAS REGISTRY NUMBER :
110623-27-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H14-Cl-N3-S
MOLECULAR WEIGHT :
267.80

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 :
200 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

  • 4-[(2S)-2-aminopropyl]-3-fluorophenol
  • (2R)-1-(2-chloro-5-methylphenyl)propan-2-amine
  • (2S)-1-(3-chloro-4-methylphenyl)propan-2-amine
  • (S)-1-(5-Fluoro-2-methylphenyl)prop-2-EN-1-amine
  • (S)-1-(4-Bromo-3-fluorophenyl)-2-methoxyethan-1-amine
  • 3-Methoxy-2,2,4,4-tetramethylcyclobutan-1-amine;hydrochloride
  • (2S)-1-(3-bromo-4-methylphenyl)propan-2-amine
  • 2-Pyridinamine, N-cyclobutyl-N,5-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 1-(3-(Chloromethyl)-4-(methylthio)phenyl)propan-1-one
  • Tert-butyl 3-oxo-4-propylpiperidine-1-carboxylate
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