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59564-78-2

59564-78-2 Structure

59564-78-2 Structure
IdentificationMore
[Name]

1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid
[CAS]

59564-78-2
[Synonyms]

1,3-BISBENZYL-2-OXOIMIDAZOLIDINE-4,5-DICARBOXYLIC ACID
1,3-DIBENZYL IMIDAZOLIDINONE-4,5-DICARBOXYLIC ACID
1,3-Dibenzyl-2-Imidaxzolidone-Cis-4,5-Dicarboxylic Acid
Vitamin H intermediates Cyclic acid
1,3-BISBENZYL-2-OXOIMIDAZOLIDINE-4,5-DI&
CYCLIC ACID
1,3-Dibenzyl-2-imidax zolidone-cis-4,5-dicarboxylic
[EINECS(EC#)]

261-806-8
[Molecular Formula]

C19H18N2O5
[MDL Number]

MFCD06798134
[Molecular Weight]

354.36
[MOL File]

59564-78-2.mol
Chemical PropertiesBack Directory
[Melting point ]

170-174 °C(lit.)
[Boiling point ]

654.2±55.0 °C(Predicted)
[density ]

1.426±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

3.74±0.40(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C19H18N2O5/c22-17(23)15-16(18(24)25)21(12-14-9-5-2-6-10-14)19(26)20(15)11-13-7-3-1-4-8-13/h1-10,15-16H,11-12H2,(H,22,23)(H,24,25)
[InChIKey]

QSMUFXXTSUEZJA-UHFFFAOYSA-N
[SMILES]

C1(=O)N(CC2=CC=CC=C2)C(C(O)=O)C(C(O)=O)N1CC1=CC=CC=C1
[CAS DataBase Reference]

59564-78-2(CAS DataBase Reference)
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Orotic acid-->m-Toluic acid-->NICLOFOLAN
Hazard InformationBack Directory
[Uses]

1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid is used as an intermediate for the drug biotin (vitamin H) and has been mass-produced. The product quality and process have been recognized by many domestic manufacturers.
Spectrum DetailBack Directory
[Spectrum Detail]

1,3-Bisbenzyl-2-oxoimidazolidine-4,5-dicarboxylic acid(59564-78-2)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

59564-78-2(sigmaaldrich)
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