CAS 4413-43-8|4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Introduction：Basic information about CAS 4413-43-8|4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Synonyms

Common Name	4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
CAS Number	4413-43-8	Molecular Weight	256.71200
Density	1.58g/cm3	Boiling Point	393.2ºC at 760mmHg
Molecular Formula	C₉H₉ClN₄OS	Melting Point	/
MSDS	/	Flash Point	191.6ºC

Names

Name	4-amino-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.58g/cm3
Boiling Point	393.2ºC at 760mmHg
Molecular Formula	C₉H₉ClN₄OS
Molecular Weight	256.71200
Flash Point	191.6ºC
Exact Mass	256.01900
PSA	104.76000
LogP	2.09420
Index of Refraction	1.723
InChIKey	VKXMIAZOMPVHIM-UHFFFAOYSA-N
SMILES	Nn1c(COc2ccc(Cl)cc2)n[nH]c1=S

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ5358470

CHEMICAL NAME :: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-((4-chlorophenoxy)methyl)-

CAS REGISTRY NUMBER :: 4413-43-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H9-Cl-N4-O-S

MOLECULAR WEIGHT :: 256.73

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 :: INDRBA Indian Drugs. (Indian Drugs Manufacturers' Assoc., 102B, Poonam Chambers, Dr. A. B. Rd., Worli, Bombay 400 018, India) V.1- 1963- Volume(issue)/page/year: 25,257,1988

Safety Information

HS Code	2933990090

Customs

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Synonyms

4-amino-5-(4-chloro-phenoxymethyl)-2,4-dihydro-[1,2,4]triazole-3-thione

3H-1,2,4-Triazole-3-thione,2,4-dihydro-4-amino-5-((4-chlorophenoxy)methyl)

4-amino-5-[(4-chlorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol

3-(4-chlorophenoxymethyl)-4-amino-5-mercapto-1,2,4-triazole

2,4-Dihydro-4-amino-5-((4-chlorophenoxy)methyl)-3H-1,2,4-triazole-3-thione

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