3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole

Modify Date: 2025-10-16 09:33:11

3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole Structure
3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole structure
 Common Name 3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole
CAS Number 85681-48-7 Molecular Weight 295.33600
Density 1.185g/cm3 Boiling Point 528.6ºC at 760 mmHg
Molecular Formula C17H17N3O2 Melting Point N/A
MSDS N/A Flash Point 186.4ºC

 Names

Name 5-(5-Methoxy-2-methylphenyl)-3-(3-methoxyphenyl)-1H-1,2,4-triazol e

 Chemical & Physical Properties

Density 1.185g/cm3
Boiling Point 528.6ºC at 760 mmHg
Molecular Formula C17H17N3O2
Molecular Weight 295.33600
Flash Point 186.4ºC
Exact Mass 295.13200
PSA 60.03000
LogP 3.46430
Index of Refraction 1.591
InChIKey XWNFKTCCFUFDRG-UHFFFAOYSA-N
SMILES COc1cccc(-c2n[nH]c(-c3cc(OC)ccc3C)n2)c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4929400
CHEMICAL NAME :
s-Triazole, 3-(5-methoxy-o-tolyl)-5-(m-methoxyphenyl)-
CAS REGISTRY NUMBER :
85681-48-7
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H17-N3-O2
MOLECULAR WEIGHT :
295.37
WISWESSER LINE NOTATION :
T5MN DNJ CR B1 EO1& ER CO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
5 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

 Safety Information

HS Code 2933990090

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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Chemsrc provides CAS#:85681-48-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole>> amp version: 3-(5-Methoxy-o-tolyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole

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