4-[[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]methyl]-2,6-dimethylphenol

Modify Date: 2025-09-20 15:20:26

4-[[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]methyl]-2,6-dimethylphenol structure	Common Name	4-[[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]methyl]-2,6-dimethylphenol
	CAS Number	104186-19-8	Molecular Weight	340.37600
	Density	1.26g/cm3	Boiling Point	548.7ºC at 760mmHg
	Molecular Formula	C₁₈H₂₀N₄O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	285.6ºC

Name	4-[[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]methyl]-2,6-dimethylphenol
Synonym	More Synonyms

Density	1.26g/cm3
Boiling Point	548.7ºC at 760mmHg
Molecular Formula	C₁₈H₂₀N₄O₃
Molecular Weight	340.37600
Flash Point	285.6ºC
Exact Mass	340.15400
PSA	82.29000
LogP	2.72800
Vapour Pressure	1.19E-12mmHg at 25°C
Index of Refraction	1.616
InChIKey	RYAQNNATFZKOMC-UHFFFAOYSA-N
SMILES	COc1ccc(-c2nnn(Cc3cc(C)c(O)c(C)c3)n2)cc1OC

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SL0947000

CHEMICAL NAME :: Phenol, 4-((5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)methyl)- 2,6-dimethyl-

CAS REGISTRY NUMBER :: 104186-19-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H20-N4-O3

MOLECULAR WEIGHT :: 340.42

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 :: 1500 mg/kg

TOXIC EFFECTS :: Behavioral - excitement Behavioral - muscle weakness

REFERENCE :: PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 20,336,1986

5-(3,4-dimethox...

CAS#:10493-27-3

2,6-dimethyl-4-...

CAS#:42900-97-0

~74%

4-[[5-(3,4-dime...

CAS#:104186-19-8

Literature: Ishmetova, R. I.; Kitaeva, V. G.; Rusinov, L. G. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1993 , vol. 29, # 8 p. 902 - 905 Khimiya Geterotsiklicheskikh Soedinenii, 1993 , # 8 p. 1060 - 1063

4-((5-(3,4-Dimethoxyphenyl)-2H-tetrazol-2-yl)methyl)-2,6-dimethylphenol

Phenol,4-((5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)methyl)-2,6-dimethyl

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4-[[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]methyl]-2,6-dimethylphenol

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Chemical & Physical Properties

Toxicological Information