116850-48-7

116850-48-7 structure

116850-48-7 structure

Name: 3-ethylsulfinyl-4-methyl-5-phenyl-1,2,4-triazole
Chemical Name: 3-ethylsulfinyl-4-methyl-5-phenyl-1,2,4-triazole
CAS Number: 116850-48-7
Molecular Formula: C₁₁H₁₃N₃OS
Molecular Weight: 235.30500
Create Date: 2017-03-21 05:39:22
Modify Date: 2024-02-13 22:08:12

Name	3-ethylsulfinyl-4-methyl-5-phenyl-1,2,4-triazole

Density	1.3g/cm3
Boiling Point	457.4ºC at 760mmHg
Molecular Formula	C₁₁H₁₃N₃OS
Molecular Weight	235.30500
Flash Point	230.4ºC
Exact Mass	235.07800
PSA	66.99000
LogP	2.47530
Vapour Pressure	1.5E-08mmHg at 25°C
Index of Refraction	1.66

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ4915410

CHEMICAL NAME :: 4H-1,2,4-Triazole, 3-(ethylsulfinyl)-4-methyl-5-phenyl-

CAS REGISTRY NUMBER :: 116850-48-7

LAST UPDATED :: 199503

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H13-N3-O-S

MOLECULAR WEIGHT :: 235.33

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