110623-39-7

110623-39-7 structure

110623-39-7 structure

Name: 5-(4-methoxyphenyl)-2,4-dimethyl-1,2,4-triazole-3-thione
Chemical Name: 5-(4-methoxyphenyl)-2,4-dimethyl-1,2,4-triazole-3-thione
CAS Number: 110623-39-7
Molecular Formula: C₁₁H₁₃N₃OS
Molecular Weight: 235.30500
Create Date: 2017-10-26 23:07:48
Modify Date: 2024-02-04 21:50:21

Name	5-(4-methoxyphenyl)-2,4-dimethyl-1,2,4-triazole-3-thione

Density	1.22g/cm3
Boiling Point	314.7ºC at 760mmHg
Molecular Formula	C₁₁H₁₃N₃OS
Molecular Weight	235.30500
Flash Point	144.1ºC
Exact Mass	235.07800
PSA	64.07000
LogP	2.16370
Vapour Pressure	0.000457mmHg at 25°C
Index of Refraction	1.619

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ5359080

CHEMICAL NAME :: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-2,4-dimethyl-5-(4-methoxyphenyl)-

CAS REGISTRY NUMBER :: 110623-39-7

LAST UPDATED :: 199612

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: 31,1253,1988

110623-58-0 structure

110623-58-0

~%

110623-39-7 structure

110623-39-7

Literature: Kane, John M.; Dudley, Mark W.; Sorensen, Stephen M.; Miller, Francis P. Journal of Medicinal Chemistry, 1988 , vol. 31, # 6 p. 1253 - 1258

100-07-2 structure

100-07-2

~%

110623-39-7 structure

110623-39-7

Literature: Kane, John M.; Dudley, Mark W.; Sorensen, Stephen M.; Miller, Francis P. Journal of Medicinal Chemistry, 1988 , vol. 31, # 6 p. 1253 - 1258