5-(4-fluorophenyl)-3-methylsulfanyl-1H-1,2,4-triazole

Names

[ CAS No. ]:
116850-62-5

[ Name ]:
5-(4-fluorophenyl)-3-methylsulfanyl-1H-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.38g/cm3

[ Boiling Point ]:
394.8ºC at 760mmHg

[ Molecular Formula ]:
C9H8FN3S

[ Molecular Weight ]:
209.24300

[ Flash Point ]:
192.6ºC

[ Exact Mass ]:
209.04200

[ PSA ]:
66.87000

[ LogP ]:
2.33270

[ Vapour Pressure ]:
1.93E-06mmHg at 25°C

[ Index of Refraction ]:
1.631

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4915800
CHEMICAL NAME :
1H-1,2,4-Triazole, 3-(4-fluorophenyl)-5-(methylthio)-
CAS REGISTRY NUMBER :
116850-62-5
LAST UPDATED :
199503
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H8-F-N3-S
MOLECULAR WEIGHT :
209.26

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: 37,125,1994

Related Compounds

  • N-(2-methoxy-2-(2-methoxyphenyl)ethyl)pentanamide
  • (E)-3-(furan-2-yl)-N-(2-methoxy-2-(2-methoxyphenyl)ethyl)acrylamide
  • 3-methoxy-N-(2-methoxy-2-(2-methoxyphenyl)ethyl)-1-methyl-1H-pyrazole-4-carboxamide
  • N-(2-methoxy-2-(2-methoxyphenyl)ethyl)-2-(2-methoxyphenoxy)acetamide
  • (E)-3-(2-chlorophenyl)-N-(2-methoxy-2-(2-methoxyphenyl)ethyl)acrylamide
  • 4-(N,N-dimethylsulfamoyl)-N-(2-methoxy-2-(2-methoxyphenyl)ethyl)benzamide
  • N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-4-(thiophen-3-yl)benzamide
  • Methyl 4-amino-2-chloro-5-(3-methoxypropyl)benzoate
  • N4-2-Pyrimidinyl-3,4-pyridinediamine
  • 2,4-Difluoro-3-iodophenol
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