2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-

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Names

[ CAS No. ]:
21914-07-8

[ Name ]:
2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-

[Synonym ]:
5,5-diphenyl-pyrimidine-2,4,6-trione
5,5-Diphenylbarbituric acid
5,5-Diphenyl-barbitursaeure
Phenobarbital
Barbituric acid,5,5-diphenyl
Barbituric acid,5-diphenyl
5,5-Diphenyl-2,4,6(1H,3H,5H)-pyrimidinetrione

Chemical & Physical Properties

[ Density]:
1.304g/cm3

[ Molecular Formula ]:
C16H12N2O3

[ Molecular Weight ]:
280.27800

[ Exact Mass ]:
280.08500

[ PSA ]:
75.27000

[ LogP ]:
1.99630

[ Index of Refraction ]:
1.608

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ4196000
CHEMICAL NAME :
Barbituric acid, 5,5-diphenyl-
CAS REGISTRY NUMBER :
21914-07-8
LAST UPDATED :
199206
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H12-N2-O3
MOLECULAR WEIGHT :
280.30
WISWESSER LINE NOTATION :
T6VMVMV FHJ FR& FR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
572 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 89,356,1947

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Barbituric acid
  • Plumbane,tris(acetyloxy)phenyl-
  • 1,3-bis(methoxymethyl)-5,5-diphenyl-1,3-diazinane-2,4,6-trione
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-dihydroxy-
  • benzene
  • diphenyl-malonic acid diamide
  • 2,2-diphenylmalonyl dichloride
  • Sulfuric acid
  • Urea

DownStream

  • N-carbamoyl-2,2-diphenyl-acetamide

Related Compounds

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[[5-(diethylamino)-2-furanyl]methylene]-1,3-diphenyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methyl]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methylene]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diethyl-1-(4-methylphenyl)-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[5-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)-2,4-pentadien-1-ylidene]-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[[5-(diethylamino)-2-furanyl]methylene]-1-(2-fluorophenyl)-
  • N-[(4-Chlorophenyl)methyl]-4-[(6-methylpyridazin-3-yl)oxymethyl]piperidine-1-carboxamide
  • 2-({4-[(Pyrimidin-2-yloxy)methyl]piperidin-1-yl}sulfonyl)benzonitrile
  • 6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-[1-(3-methoxy-1-methyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]-2,3-dihydropyridazin-3-one
  • 6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-{1-[2-(methylsulfanyl)pyridine-3-carbonyl]piperidin-4-yl}-2,3-dihydropyridazin-3-one
  • 2-Methyl-6-[(1-phenylmethanesulfonylpiperidin-3-yl)methoxy]pyridine
  • 5-Chloro-6-[3-(2-oxo-1,3-oxazolidin-3-yl)pyrrolidin-1-yl]pyridine-3-carbonitrile
  • 4,5-Dimethyl-6-(1,2,3,6-tetrahydropyridin-1-yl)pyrimidine
  • 2-{[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]methoxy}pyrimidine
  • 2-[3-({[3-(Trifluoromethyl)pyridin-2-yl]oxy}methyl)piperidin-1-yl]acetamide
  • 1-[4-[(1S,2S)-2-Hydroxy-2-methylcyclobutyl]piperazin-1-yl]ethanone
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