3-(4-Chloro-2-methylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole

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Names

[ CAS No. ]:
75318-76-2

[ Name ]:
3-(4-Chloro-2-methylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole

Chemical & Physical Properties

[ Density]:
1.264g/cm3

[ Boiling Point ]:
513.8ºC at 760 mmHg

[ Molecular Formula ]:
C16H14ClN3O

[ Molecular Weight ]:
299.75500

[ Flash Point ]:
264.5ºC

[ Exact Mass ]:
299.08300

[ PSA ]:
50.80000

[ LogP ]:
4.10910

[ Index of Refraction ]:
1.612

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4504000
CHEMICAL NAME :
s-Triazole, 3-(4-chloro-o-tolyl)-5-(m-methoxyphenyl)-
CAS REGISTRY NUMBER :
75318-76-2
LAST UPDATED :
199709
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C16-H14-Cl-N3-O
MOLECULAR WEIGHT :
299.78
WISWESSER LINE NOTATION :
T5MN DNJ CR DG B1& ER CO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
2500 ug/kg
SEX/DURATION :
female 6-10 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 :
Oral
DOSE :
25 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 :
200 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
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
200 ug/kg
SEX/DURATION :
female 4-8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - other measures of fertility
REFERENCE :
RDMIDP Quarterly Reviews on Drug Metabolism and Drug Interactions. (Freund Pub. House, Suite 500, Chesham House, 150 Regent St., London W1R 5FA, UK) V.3- 1980- Volume(issue)/page/year: 4,237,1982

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 2-(3-ethyl-1H-indol-7-yl)acetic acid
  • 2-[3-Amino-2-(chloromethyl)propoxy]-5-methylpyrimidine
  • 3-(Azetidin-3-yl)-5-methyl-4-phenethyl-4H-1,2,4-triazole
  • 3-(azetidin-3-yl)-4-[(2,6-difluorophenyl)methyl]-5-methyl-4H-1,2,4-triazole
  • 4-[3-Amino-2-(chloromethyl)propoxy]-5-fluoropyrimidine
  • dimethyl({2-[3-methyl-5-(pyrrolidin-3-yl)-4H-1,2,4-triazol-4-yl]ethyl})amine
  • 4-butyl-3-methyl-5-(pyrrolidin-3-yl)-4H-1,2,4-triazole
  • 1-(3-methoxypyridin-2-yl)-1H-indazol-4-amine
  • 4-[(4-fluorophenyl)methyl]-3-methyl-5-(pyrrolidin-3-yl)-4H-1,2,4-triazole
  • 1-(isoquinolin-4-yl)-1H-indazol-4-amine