1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole

Modify Date: 2024-01-14 09:42:26

1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole structure	Common Name	1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole
	CAS Number	99793-38-1	Molecular Weight	336.23900
	Density	1.39g/cm3	Boiling Point	511.8ºC at 760 mmHg
	Molecular Formula	C₁₅H₁₁Cl₂N₃S	Melting Point	N/A
	MSDS	N/A	Flash Point	263.3ºC

Name	1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole

Density	1.39g/cm3
Boiling Point	511.8ºC at 760 mmHg
Molecular Formula	C₁₅H₁₁Cl₂N₃S
Molecular Weight	336.23900
Flash Point	263.3ºC
Exact Mass	335.00500
PSA	56.01000
LogP	4.96300
Index of Refraction	1.678

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ4098000

CHEMICAL NAME :: 1H-1,2,4-Triazole, 1,5-bis(4-chlorophenyl)-3-(methylthio)-

CAS REGISTRY NUMBER :: 99793-38-1

LAST UPDATED :: 199709

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C15-H11-Cl2-N3-S

MOLECULAR WEIGHT :: 336.25

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 770 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 25,95,1990

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 155 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 25,95,1990

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 25,95,1990

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 450 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 25,95,1990

N/A structure

N/A

CAS#:99793-83-6

Dimethyl sulfate structure

Dimethyl sulfate

CAS#:77-78-1

~97%

1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole Structure

1,5-bis(4-chlor...

CAS#:99793-38-1

Literature: Szilagyi, Geza; Somorai, Tamas; Bozo, Eva; Lango, Jozsef; Nagy, Gabor; et al. European Journal of Medicinal Chemistry, 1990 , vol. 25, # 2 p. 95 - 101

4-Chlorobenzoyl chloride structure

4-Chlorobenzoyl...

CAS#:122-01-0

~%

1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole Structure

1,5-bis(4-chlor...

CAS#:99793-38-1

Literature: Szilagyi, Geza; Somorai, Tamas; Bozo, Eva; Lango, Jozsef; Nagy, Gabor; et al. European Journal of Medicinal Chemistry, 1990 , vol. 25, # 2 p. 95 - 101

[(4-chlorophenyl)amino]thiourea structure

[(4-chloropheny...

CAS#:7382-41-4

~%

1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole Structure

1,5-bis(4-chlor...

CAS#:99793-38-1

Literature: Szilagyi, Geza; Somorai, Tamas; Bozo, Eva; Lango, Jozsef; Nagy, Gabor; et al. European Journal of Medicinal Chemistry, 1990 , vol. 25, # 2 p. 95 - 101

N/A structure

N/A

CAS#:99793-83-6

methyl iodide structure

methyl iodide

CAS#:74-88-4

~%

1,5-bis(4-chlorophenyl)-3-methylsulfanyl-1,2,4-triazole Structure

1,5-bis(4-chlor...

CAS#:99793-38-1

Literature: Szilagyi, Geza; Somorai, Tamas; Bozo, Eva; Lango, Jozsef; Nagy, Gabor; et al. European Journal of Medicinal Chemistry, 1990 , vol. 25, # 2 p. 95 - 101

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