116850-61-4

116850-61-4 structure

116850-61-4 structure

Name: 3-ethylsulfanyl-4-methyl-5-phenyl-1,2,4-triazole
Chemical Name: 3-ethylsulfanyl-4-methyl-5-phenyl-1,2,4-triazole
CAS Number: 116850-61-4
Molecular Formula: C₁₁H₁₃N₃S
Molecular Weight: 219.30600
Create Date: 2017-05-09 03:37:27
Modify Date: 2024-04-09 17:26:29

Name	3-ethylsulfanyl-4-methyl-5-phenyl-1,2,4-triazole
Synonyms	5-ethylthio-4-methyl-3-phenyl-4H-1,2,4-triazole

Density	1.18g/cm3
Boiling Point	397.2ºC at 760mmHg
Molecular Formula	C₁₁H₁₃N₃S
Molecular Weight	219.30600
Flash Point	194ºC
Exact Mass	219.08300
PSA	56.01000
LogP	2.59410
Vapour Pressure	1.61E-06mmHg at 25°C
Index of Refraction	1.625

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ4915450

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

CAS REGISTRY NUMBER :: 116850-61-4

LAST UPDATED :: 199503

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H13-N3-S

MOLECULAR WEIGHT :: 219.33

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 :: 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