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54504-70-0

54504-70-0 Structure

54504-70-0 Structure
IdentificationBack Directory
[Name]

ETOFYLLINE CLOFIBRATE
[CAS]

54504-70-0
[Synonyms]

duolip
ml1024
Theofibrate
etofyllinclofibrat
etofyllinclofibrate
ETOFYLLINE CLOFIBRATE
Etofylline cIofibrate
ETOFYLLINE CLOFIBRATE USP/EP/BP
yl-2,6-dioxo-7h-purin-7-yl)ethylester
1-(7-theophyllinyl)-2-ethyl(2-(p-chlorophenoxy)isobutyrate)
1-(theophyllin-7-yl)-aethyl-22-(p-chlorphenoxy)-2-methylpropionat
1-(theophyllin-7-yl)-ethyl-22-(p-chlorophenoxy)-2-methylpropionate
propionicacid,2-(4-chlorophenoxy)-2-methyl-,2-(1,2,3,6-tetrahydro-1,3-dimeth
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl 2-(4-chlorophenoxy)-2-methylpropanoate
2-(4-Chlorophenoxy)-2-methylpropionic acid 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester
2-(4-Chlorophenoxy)-2-methylpropionic acid [2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl] ester
Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester
[EINECS(EC#)]

259-191-6
[Molecular Formula]

C19H21ClN4O5
[MDL Number]

MFCD01695637
[MOL File]

54504-70-0.mol
[Molecular Weight]

420.85
Chemical PropertiesBack Directory
[Melting point ]

133-135°
[Boiling point ]

615.8±65.0 °C(Predicted)
[density ]

1.3758 (rough estimate)
[refractive index ]

1.6500 (estimate)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: 52 mg/mL (123.56 mM)
[form ]

Solid
[pka]

0.17±0.70(Predicted)
[color ]

Light yellow to yellow
Hazard InformationBack Directory
[Originator]

Duolip,Merckle,W. Germany,1981
[Uses]

Duolip (L. Merckle, Germany).
[Definition]

ChEBI: Etofylline clofibrate is an oxopurine.
[Manufacturing Process]

107.3 g (0.5 mol) 2-(p-chlorophenoxy)isobutyric acid and 56.0 g (0.25 mol) 7-hydroxyethyltheophylline were suspended together in 250 ml xylene. They were heated together for 15 hours in a water separator following the addition of 1.5 g p-toluenesulfonic acid. The solution was next agitated with dilute sodium bicarbonate solution (0.5 mol NaHCO3), water washed and evaporated in a rotary evaporator.
The residue was then crystallized from isopropanol, yielding 58.0 g (55% yield) of 1-(7-theophyllinyl)-2-ethyl[2-(p-chlorophenoxy)-isobutyrate] . The compound had a melting point of 131°C to 132°C.
[Therapeutic Function]

Antihyperlipidemic
[storage]

Store at -20°C
Safety DataBack Directory
[Toxicity]

LD50 in mice, rats, dogs (g/kg): 11.7, 17.0, >10.0 orally (Metz et al.)
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