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27470-51-5

27470-51-5 Structure

27470-51-5 Structure
IdentificationBack Directory
[Name]

4-BUTYL-4-[HYDROXYMETHYL]-1,2-DIPHENYL-3,5-PYRAZOLIDINEDIONE HYDROGEN SUCCINATE [ESTER]
[CAS]

27470-51-5
[Synonyms]

ae-17
alfide
flogos
solurol
Aflogan
Calibene
Suxibuzona
SUXIBUZONE
lidinedione
Suxibuzonum
Suxibuzone CRS
Acetanilide Impurity 1
4-Hydroxymethylbutazolidine hemisuccinate
butanedioicacid,mono((4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)methyl
succinicacid,monoesterwith4-butyl-4-(hydroxymethyl)-1,2-diphenyl-3,5-pyrazo
4-butyl-4-hydroxymethyl-1,2-diphenyl-3,5-pyrazolidinedionehydrogensuccinate
4-butyl-4-(beta-carboxypropionyl-oxymethyl)-1,2-diphenyl-3,5-pyrazolidinedio
4-Butyl-4-(beta-carboxypropionyl-oxymethyl)-1,2-diphenyl-3,5-pyrazolidinedione
4-((4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)methoxy)-4-oxobutanoic acid
3-((4-Butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)methoxycarbonyl)propionsaeure
3-(1,2-Diphenyl-3,5-dioxo-4-butylpyrazolidine-4-ylmethoxycarbonyl)propionic acid
Butanedioic acid, 1-[(4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)methyl] ester
Succinic acid hydrogen (1,2-diphenyl-3,5-dioxo-4-butylpyrazolidin-4-yl)methyl ester
Succinic acid hydrogen (4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)methyl ester
Succinic acid hydrogen 1-[(4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)methyl] ester
4-BUTYL-4-[HYDROXYMETHYL]-1,2-DIPHENYL-3,5-PYRAZOLIDINEDIONE HYDROGEN SUCCINATE [ESTER]
3,5-Pyrazolidinedione, 4-butyl-4-(hydroxymethyl)-1,2-diphenyl-, hydrogen succinate (ester)
[EINECS(EC#)]

248-477-6
[Molecular Formula]

C24H26N2O6
[MDL Number]

MFCD00079562
[MOL File]

27470-51-5.mol
[Molecular Weight]

438.47
Chemical PropertiesBack Directory
[Appearance]

White or almost white, crystalline powder.
[Melting point ]

126-127°
[Boiling point ]

550.33°C (rough estimate)
[density ]

1.2847 (rough estimate)
[refractive index ]

1.6300 (estimate)
[storage temp. ]

2-8°C
[solubility ]

Practically insoluble in water, freely soluble in acetone, soluble in ethanol (96 per cent), practically insoluble in cyclohexane.
[form ]

neat
[pka]

4.33±0.17(Predicted)
[color ]

White to Off-White
[Major Application]

pharmaceutical (small molecule)
[InChI]

1S/C24H26N2O6/c1-2-3-16-24(17-32-21(29)15-14-20(27)28)22(30)25(18-10-6-4-7-11-18)26(23(24)31)19-12-8-5-9-13-19/h4-13H,2-3,14-17H2,1H3,(H,27,28)
[InChIKey]

ONWXNHPOAGOMTG-UHFFFAOYSA-N
[SMILES]

CCCCC1(COC(=O)CCC(O)=O)C(=O)N(N(C1=O)c2ccccc2)c3ccccc3
[CAS DataBase Reference]

27470-51-5
Hazard InformationBack Directory
[Chemical Properties]

White or almost white, crystalline powder.
[Uses]

analgesic, antipyretic, antiinflammatory
[Definition]

ChEBI: A pyrazolidine that is phenylbutazone which is substituted by a 3-carboxypropanoylmethyl group at the 4-position. Suxibuzone is a prodrug for phenylbutazone and is commonly used as an anti-inflammatory drug in horses.
[Brand name]

Calibene;Danalon om;Danilon;Flamilon;Flofos.
[World Health Organization (WHO)]

Suxibuzone, a pyrazolone derivative with anti-inflammatory, analgesic and antipyretic activity, was introduced in 1974 for the treatment of rheumatic disorders. As it is structurally related to phenylbutazone, it is subjected to rigorously restricted indications by some national regulatory authorities. See WHO comment for phenylbutazone.
[Biochem/physiol Actions]

A prodrug of phenylbutazone.
[storage]

Store at -20°C
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22
[Safety Statements ]

36
[WGK Germany ]

3
[RTECS ]

WM9640000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
[Toxicity]

LD50 orally in mice: 5.683 micromol/kg (Esteve, 1973)
Spectrum DetailBack Directory
[Spectrum Detail]

4-BUTYL-4-[HYDROXYMETHYL]-1,2-DIPHENYL-3,5-PYRAZOLIDINEDIONE HYDROGEN SUCCINATE [ESTER](27470-51-5)1HNMR
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