ChemicalBook--->CAS DataBase List--->58042-96-9

58042-96-9

58042-96-9 Structure

58042-96-9 Structure
IdentificationBack Directory
[Name]

(5RS)-5-Ethyl-6-diimino-5-phenyl-5,6-dihydropyrimidin-2,4-(1H,3H)-dione
[CAS]

58042-96-9
[Synonyms]

Phenobarbital impurity B
Phenobarbital Impurity C
Phenobarbital EP Impurity B
6-amino-5-ethyl-5-phenyl-5H-pyrimidine-2,4-dione
6-Amino-5-ethyl-5-phenyl-2,4(3H,5H)-pyrimidinedione
Phenobarbital Impurity 2(Phenobarbital EP Impurity B)
2,4(3H,5H)-Pyrimidinedione, 6-amino-5-ethyl-5-phenyl-
(5RS)-5-Ethyl-6-imino-5-phenyldihydropyrimidine-2,4(1H,3H)-dione
(5RS)-5-Ethyl-6-diimino-5-phenyl-5,6-dihydropyrimidin-2,4-(1H,3H)-dione
[Molecular Formula]

C12H13N3O2
[MDL Number]

MFCD27967071
[MOL File]

58042-96-9.mol
[Molecular Weight]

231.25
Chemical PropertiesBack Directory
[Melting point ]

264 °C
[density ]

1.32±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly), Methanol (Slightly), Water (Slightly)
[form ]

Solid
[pka]

8.17±0.60(Predicted)
[color ]

White to Off-White
[Major Application]

pharmaceutical (small molecule)
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P301+P330+P331+P310
[WGK Germany ]

WGK 3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Hazard InformationBack Directory
[Uses]

6-Amino-5-ethyl-5-phenyl-2,4(3H,5H)-pyrimidinedione is a Phenobarbital (P316760) impurity, a controlled substance (depressant). Anticonvulsant; sedative; hypnotic.
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