1-[[2-(1-benzofuran-2-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole

Modify Date: 2025-12-02 11:27:56

1-[[2-(1-benzofuran-2-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole Structure
1-[[2-(1-benzofuran-2-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole structure
Common Name 1-[[2-(1-benzofuran-2-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
CAS Number 98532-65-1 Molecular Weight 271.27100
Density 1.43g/cm3 Boiling Point 466.8ºC at 760 mmHg
Molecular Formula C14H13N3O3 Melting Point N/A
MSDS N/A Flash Point 236.1ºC

 Names

Name 1-[[2-(1-benzofuran-2-yl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole

 Chemical & Physical Properties

Density 1.43g/cm3
Boiling Point 466.8ºC at 760 mmHg
Molecular Formula C14H13N3O3
Molecular Weight 271.27100
Flash Point 236.1ºC
Exact Mass 271.09600
PSA 62.31000
LogP 1.92410
Index of Refraction 1.682
InChIKey WJXMCVUDLYYCHQ-UHFFFAOYSA-N
SMILES c1ccc2oc(C3(Cn4cncn4)OCCO3)cc2c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4093540
CHEMICAL NAME :
1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-1,3-dioxolan-2-yl)methyl)-
CAS REGISTRY NUMBER :
98532-65-1
LAST UPDATED :
199609
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H13-N3-O3
MOLECULAR WEIGHT :
271.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EPXXDW European Patent Application. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #0130151
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EPXXDW European Patent Application. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #0130151
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