3-ethylsulfinyl-4-methyl-5-phenyl-1,2,4-triazole

Names

[ CAS No. ]:
116850-48-7

[ Name ]:
3-ethylsulfinyl-4-methyl-5-phenyl-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.3g/cm3

[ Boiling Point ]:
457.4ºC at 760mmHg

[ Molecular Formula ]:
C11H13N3OS

[ Molecular Weight ]:
235.30500

[ Flash Point ]:
230.4ºC

[ Exact Mass ]:
235.07800

[ PSA ]:
66.99000

[ LogP ]:
2.47530

[ Vapour Pressure ]:
1.5E-08mmHg at 25°C

[ Index of Refraction ]:
1.66

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4915410
CHEMICAL NAME :
4H-1,2,4-Triazole, 3-(ethylsulfinyl)-4-methyl-5-phenyl-
CAS REGISTRY NUMBER :
116850-48-7
LAST UPDATED :
199503
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H13-N3-O-S
MOLECULAR WEIGHT :
235.33

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

  • 3-methoxy-4-methyl-5-phenyl-1,2,4-triazole
  • 3-ethylsulfonyl-4-methyl-5-phenyl-1,2,4-triazole
  • 3-ethylsulfanyl-4-methyl-5-phenyl-1,2,4-triazole
  • 3-(Chloromethyl)-4-methyl-5-phenyl-4H-1,2,4-triazole hydrochloride (1:1)
  • 3-(4-chlorophenyl)-1-methyl-5-phenyl-1H-1,2,4-triazole
  • 3-(Adamantan-1-yl)-4-methyl-5-phenyl-4H-1,2,4-triazole
  • 4-({5-Cyano-4-methyl-6-[(4-sulfophenyl)amino]pyridin-2-yl}amino)benzene-1-sulfonic acid
  • 4-(3-Morpholin-4-ylmethyl-phenyl)-1h-pyrrolo[2,3-b]pyridine
  • 5-Ethyl-6-methyl-2-(phenylmethoxy)-3-pyridineacetaldehyde
  • 6-(Pyridin-3-yl-[1,2,4]oxadiazol-5-yl)pyridine-2-carbonitrile
  • 4,4'-(4A,9a-dihydro-9H-fluorene-9,9-diyl)bis(2-methylphenol)
  • 5-(3-Pyridin-3-yl-[1,2,4]oxadiazol-5-yl)furan-2-carbonitrile
  • 5-(3-Pyridin-3-yl-[1,2,4]oxadiazol-5-yl)-thiophene-2-carbonitrile
  • Acetylechimidine
  • N-{2-[(Acetylamino)methyl]-1,3-benzothiazol-5-yl}-4-tert-butylbenzamide
  • N-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide
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