2,4-Dihydro-4-(4-ethoxyphenyl)-5-((2-methoxyphenoxy)methyl)-3H-1,2,4-t riazole-3-thione

Modify Date: 2025-11-26 16:30:28

2,4-Dihydro-4-(4-ethoxyphenyl)-5-((2-methoxyphenoxy)methyl)-3H-1,2,4-t riazole-3-thione structure	Common Name	2,4-Dihydro-4-(4-ethoxyphenyl)-5-((2-methoxyphenoxy)methyl)-3H-1,2,4-t riazole-3-thione
	CAS Number	107952-08-9	Molecular Weight	357.42700
	Density	1.26g/cm3	Boiling Point	492.5ºC at 760mmHg
	Molecular Formula	C₁₈H₁₉N₃O₃S	Melting Point	N/A
	MSDS	N/A	Flash Point	251.6ºC

Name	4-(4-ethoxyphenyl)-3-[(2-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione

Density	1.26g/cm3
Boiling Point	492.5ºC at 760mmHg
Molecular Formula	C₁₈H₁₉N₃O₃S
Molecular Weight	357.42700
Flash Point	251.6ºC
Exact Mass	357.11500
PSA	97.20000
LogP	3.54230
Vapour Pressure	7.64E-10mmHg at 25°C
Index of Refraction	1.616
InChIKey	KAPSLFSVTQLWNY-UHFFFAOYSA-N
SMILES	CCOc1ccc(-n2c(COc3ccccc3OC)n[nH]c2=S)cc1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XZ5359086

CHEMICAL NAME :: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-ethoxyphenyl)-5-((2-methoxyphenoxy)m ethyl)-

CAS REGISTRY NUMBER :: 107952-08-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H19-N3-O3-S

MOLECULAR WEIGHT :: 357.46

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 :: >1 gm/kg

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

REFERENCE :: IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 26,251,1987

HS Code	2933990090

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%

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