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

Modify Date: 2023-01-17 20:05:17

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

 Names

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

 Chemical & Physical Properties

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

 Toxicological Information

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

 Synthetic Route

~74%

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

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

 Synonyms

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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