4H-1,2,4-Triazole, 4-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)-5-(p henoxymethyl)-

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Names

[ CAS No. ]:
141079-12-1

[ Name ]:
4H-1,2,4-Triazole, 4-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)-5-(p henoxymethyl)-

[Synonym ]:
4H-1,2,4-Triazole,4-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)-5-(phenoxymethyl)
4-(3-Chloro-4-fluorophenyl)-3-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.26g/cm3

[ Boiling Point ]:
578.6ºC at 760mmHg

[ Molecular Formula ]:
C22H17ClFN3O

[ Molecular Weight ]:
393.84100

[ Flash Point ]:
303.7ºC

[ Exact Mass ]:
393.10400

[ PSA ]:
39.94000

[ LogP ]:
5.61420

[ Vapour Pressure ]:
2.21E-13mmHg at 25°C

[ Index of Refraction ]:
1.622

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4392000
CHEMICAL NAME :
4H-1,2,4-Triazole, 4-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)-5-(phe noxymethyl)-
CAS REGISTRY NUMBER :
141079-12-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C22-H17-Cl-F-N3-O
MOLECULAR WEIGHT :
393.87

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 31,289,1992

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (2S,3R)-3-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-[5-(dimethylamino)-3H-imidazo[4,5-b]pyridin-2-yl]acetate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 7-fluoro-12-methyl-4-oxo-1-azatricyclo[7.3.1.0,5,13]trideca-2,5,7,9(13)-tetraene-3-carboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-(1H-pyrazol-1-yl)benzoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 3-(1,3-benzoxazol-2-yl)propanoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5-phenyl-1H-pyrazole-3-carboxylate
  • tert-butyl N-{3-[hydroxy(phenyl)methyl]phenyl}carbamate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 3-(2,5-dimethylthiophen-3-yl)propanoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-methyl-4H-pyrrolo[3,2-d][1,3]thiazole-5-carboxylate
  • 3-[2-(Methoxymethyl)-1,3-thiazol-4-yl]-1,2-oxazole-5-carboxylic acid
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