3-(4-Chloro-o-tolyl)-5-phenyl-1H-1,2,4-triazole

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Names

[ CAS No. ]:
85303-94-2

[ Name ]:
3-(4-Chloro-o-tolyl)-5-phenyl-1H-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.266g/cm3

[ Boiling Point ]:
476.6ºC at 760 mmHg

[ Molecular Formula ]:
C15H12ClN3

[ Molecular Weight ]:
269.72900

[ Flash Point ]:
274.2ºC

[ Exact Mass ]:
269.07200

[ PSA ]:
41.57000

[ LogP ]:
4.10050

[ Index of Refraction ]:
1.629

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4506000
CHEMICAL NAME :
s-Triazole, 3-(4-chloro-o-tolyl)-5-phenyl-
CAS REGISTRY NUMBER :
85303-94-2
LAST UPDATED :
199709
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C15-H12-Cl-N3
MOLECULAR WEIGHT :
269.75
WISWESSER LINE NOTATION :
T5MN DNJ CR DG B1& ER

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
20 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
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
700 ug/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

  • 3-(5-Chloro-o-tolyl)-5-phenyl-1H-1,2,4-triazole
  • 3-(4-chlorophenyl)-1-methyl-5-phenyl-1H-1,2,4-triazole
  • 3-phenyl-5-[4-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]-1H-1,2,4-triazole
  • 3-(4-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
  • 3-(4-Chloro-2-methylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
  • 3-(2-Ethylphenyl)-5-phenyl-1H-1,2,4-triazole
  • O-(Perfluorobenzoyl)hydroxylamine
  • 2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)-N-phenylacetamide
  • ethyl 4-(2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamido)benzoate
  • N-(3-fluorophenyl)-2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamide
  • N-(4-ethylphenyl)-2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamide
  • N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamide
  • 2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)-N-(o-tolyl)acetamide
  • N-(5-chloro-2-methoxyphenyl)-2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamide
  • N-(3-acetamidophenyl)-2-(5-methoxy-4-oxo-2-((pyrimidin-2-ylthio)methyl)pyridin-1(4H)-yl)acetamide
  • N-(2-fluorophenyl)-2-(5-methoxy-2-(((4-methylpyrimidin-2-yl)thio)methyl)-4-oxopyridin-1(4H)-yl)acetamide
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