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72846-00-5

72846-00-5 Structure

72846-00-5 Structure
IdentificationMore
[Name]

1-Phenylmethyl-5-phenyl-barbituric acid
[CAS]

72846-00-5
[Synonyms]

1-BENZYL-5-PHENYLBARBITURIC ACID
1-PHENYLMETHYL-5-PHENYL-BARBITURIC ACID
BENZYL-5-PHENYLBARBITURIC ACID
LABOTEST-BB LT00454619
6(1h,3h,5h)-pyrimidinetrione,5-phenyl-1-(phenylmethyl)-4
1-Benzyl-5-phenyl-1-barbituric acid
1-Benzyl-5-phenylbarbituric acid, 98+%
1-Benzyl-5-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
5-Phenyl-1-(phenylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
[EINECS(EC#)]

276-940-2
[Molecular Formula]

C17H14N2O3
[MDL Number]

MFCD00082750
[Molecular Weight]

294.3
[MOL File]

72846-00-5.mol
Chemical PropertiesBack Directory
[Melting point ]

163-165°C
[density ]

1.304±0.06 g/cm3(Predicted)
[pka]

4.29±0.20(Predicted)
[Water Solubility ]

Soluble in acetone. Slightly soluble in water.
[InChI]

InChI=1S/C17H14N2O3/c20-15-14(13-9-5-2-6-10-13)16(21)19(17(22)18-15)11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H,18,20,22)
[InChIKey]

KCWWCWMGJOWTMY-UHFFFAOYSA-N
[SMILES]

C1(=O)N(CC2=CC=CC=C2)C(=O)C(C2=CC=CC=C2)C(=O)N1
[LogP]

2.3 at 20℃
[CAS DataBase Reference]

72846-00-5(CAS DataBase Reference)
[EPA Substance Registry System]

72846-00-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

25
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[TSCA ]

Yes
[REACH Registrations]

Active
Hazard InformationBack Directory
[Uses]

1-Benzyl-5-phenylbarbituric acid is useful as a pharmaceutical intermediate in organic synthesis.
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1-Benzyl-5-phenylbarbituric acid, 98+%(72846-00-5)
[TCI AMERICA]

1-Benzyl-5-phenylbarbituric Acid,>98.0%(T)(72846-00-5)
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