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

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Names

[ CAS No. ]:
85303-99-7

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

Chemical & Physical Properties

[ Density]:
1.156g/cm3

[ Boiling Point ]:
493ºC at 760 mmHg

[ Molecular Formula ]:
C17H17N3O

[ Molecular Weight ]:
279.33600

[ Flash Point ]:
175.3ºC

[ Exact Mass ]:
279.13700

[ PSA ]:
50.80000

[ LogP ]:
3.70970

[ Index of Refraction ]:
1.596

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4911900
CHEMICAL NAME :
s-Triazole, 3-(o-ethylphenyl)-5-(p-methoxyphenyl)-
CAS REGISTRY NUMBER :
85303-99-7
LAST UPDATED :
199709
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C17-H17-N3-O
MOLECULAR WEIGHT :
279.37
WISWESSER LINE NOTATION :
T5MN DNJ CR B2& ER DO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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 :
750 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 :
750 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

  • 3-(3,4-Dimethoxyphenyl)-2,6-difluoroaniline
  • methyl N-[(2,5-dimethylphenyl)carbamothioyl]carbamate
  • 7-Tert-butyl-2,2-dimethyl-5-oxa-9-azaspiro[3.5]nonane
  • 6-(chloromethyl)-2-methyl-5H,6H,7H,8H-[1,2,4]triazolo[1,5-a]pyridine
  • Tert-butyl 4-(azetidin-1-yl)azepane-1-carboxylate
  • rac-[(2R,3R)-3-(piperidin-1-yl)oxolan-2-yl]methanamine
  • Tert-butyl 4-{4-[(tert-butoxy)carbonyl]piperazin-1-yl}azepane-1-carboxylate
  • 1-(2-Bromo-5-methylphenyl)cyclopropane-1-carbonitrile
  • 1-{1-[4-(1H-pyrazol-1-yl)phenyl]cyclopropyl}ethan-1-one
  • (3,4-Dihydroxy-5-methoxyphenyl)methyl sulfamate
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