3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole

Modify Date: 2025-08-23 17:51:38

3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole Structure
3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole structure
 Common Name 3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole
CAS Number 154106-12-4 Molecular Weight 255.26900
Density 1.43g/cm3 Boiling Point 454.7ºC at 760 mmHg
Molecular Formula C10H10FN3O2S Melting Point N/A
MSDS N/A Flash Point 228.8ºC

 Names

Name 3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole

 Chemical & Physical Properties

Density 1.43g/cm3
Boiling Point 454.7ºC at 760 mmHg
Molecular Formula C10H10FN3O2S
Molecular Weight 255.26900
Flash Point 228.8ºC
Exact Mass 255.04800
PSA 73.23000
LogP 2.10550
Vapour Pressure 1.86E-08mmHg at 25°C
Index of Refraction 1.622
InChIKey MKEGAUDAHBKFIZ-UHFFFAOYSA-N
SMILES Cn1nc(-c2cccc(F)c2)nc1S(C)(=O)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ4915520
CHEMICAL NAME :
1H-1,2,4-Triazole, 3-(3-fluorophenyl)-1-methyl-5-(methylsulfonyl)-
CAS REGISTRY NUMBER :
154106-12-4
LAST UPDATED :
199503
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H10-F-N3-O2-S
MOLECULAR WEIGHT :
255.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 37,125,1994
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Chemsrc provides CAS#:154106-12-4 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole>> amp version: 3-(3-fluorophenyl)-1-methyl-5-methylsulfonyl-1,2,4-triazole

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