116850-66-9

116850-66-9 structure

116850-66-9 structure

Name: 3-ethylsulfonyl-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole
Chemical Name: 3-ethylsulfonyl-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole
CAS Number: 116850-66-9
Molecular Formula: C₁₁H₁₂FN₃O₂S
Molecular Weight: 269.29500
Create Date: 2016-01-21 07:50:17
Modify Date: 2024-02-06 10:05:00

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

Density	1.38g/cm3
Boiling Point	458.1ºC at 760 mmHg
Molecular Formula	C₁₁H₁₂FN₃O₂S
Molecular Weight	269.29500
Flash Point	230.8ºC
Exact Mass	269.06300
PSA	73.23000
LogP	2.49560
Vapour Pressure	1.42E-08mmHg at 25°C
Index of Refraction	1.61

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ4915420

CHEMICAL NAME :: 4H-1,2,4-Triazole, 3-(ethylsulfonyl)-5-(2-fluorophenyl)-4-methyl-

CAS REGISTRY NUMBER :: 116850-66-9

LAST UPDATED :: 199503

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H12-F-N3-O2-S

MOLECULAR WEIGHT :: 269.32

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 :: >800 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