3-(o-Tolyl)-5-(α,α,α-trifluoro-m-tolyl)-1H-1,2,4-triazole

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Names

[ CAS No. ]:
69095-77-8

[ Name ]:
3-(o-Tolyl)-5-(α,α,α-trifluoro-m-tolyl)-1H-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.292g/cm3

[ Boiling Point ]:
453.1ºC at 760 mmHg

[ Molecular Formula ]:
C16H12F3N3

[ Molecular Weight ]:
303.28200

[ Flash Point ]:
227.8ºC

[ Exact Mass ]:
303.09800

[ PSA ]:
41.57000

[ LogP ]:
4.46590

[ Index of Refraction ]:
1.56

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5360800
CHEMICAL NAME :
s-Triazole, 3-(o-tolyl)-5-(alpha,alpha,alpha-trifluoro-m-tolyl)-
CAS REGISTRY NUMBER :
69095-77-8
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H12-F3-N3
MOLECULAR WEIGHT :
303.31
WISWESSER LINE NOTATION :
T5MN DNJ CR B1& ER CXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
3 mg/kg
SEX/DURATION :
female 4-8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
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: 26,1187,1983

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 2-(Difluoromethyl)-4,6-dihydroxypyridine-3-sulfonamide
  • 2-(Difluoromethyl)-4-(trifluoromethyl)pyridine-3-carboxaldehyde
  • 2-(Difluoromethyl)-3-iodo-6-methoxypyridine-4-sulfonamide
  • 2-(Difluoromethyl)-3-fluoro-4-hydroxypyridine-6-carboxylic acid
  • 2-(Difluoromethyl)-3-methoxy-4-methylpyridine-6-acetonitrile
  • 2-(Difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-4-carboxaldehyde
  • 2-(Difluoromethyl)-4-fluoro-5-iodopyridine-3-acetic acid
  • 2-(Difluoromethyl)-3-methoxy-4-nitropyridine-5-carboxaldehyde
  • 2-(Chloromethyl)-6-(difluoromethyl)-4-methylpyridine-3-carboxaldehyde
  • 2-(Chloromethyl)-7-(trifluoromethoxy)benzo[d]oxazole
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