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

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Names

[ CAS No. ]:
2565-43-7

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

[Synonym ]:
5-allyl-pyrimidine-2,4,6-trione
5-Allyl-2,4,6-pyrimidinetrione
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(2-propenyl)
Deallylallobarbitone
5-Allylbarbituric acid
5-Allyl-barbitursaeure
5-Allyl-barbital
BARBITURIC ACID,5-ALLYL

Chemical & Physical Properties

[ Density]:
1.225g/cm3

[ Molecular Formula ]:
C7H8N2O3

[ Molecular Weight ]:
168.15000

[ Exact Mass ]:
168.05300

[ PSA ]:
75.27000

[ LogP ]:
0.20230

[ Index of Refraction ]:
1.483

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CP8115000
CHEMICAL NAME :
Barbituric acid, 5-allyl-
CAS REGISTRY NUMBER :
2565-43-7
BEILSTEIN REFERENCE NO. :
0006978
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H8-N2-O3

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 :
600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 106,504,1986

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Ethyl allylmalonate
  • Urea
  • Barbituric acid
  • allyl bromide
  • SECOBARBITAL
  • Sodium ethoxide
  • Ethanol
  • Sodium acetate

DownStream

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(2-buten-1-yl)-5-(2-propen-1-yl)-
  • allylmalonic acid
  • Talbutal

Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • (3S)-5-{[(benzyloxy)carbonyl]amino}-3-hydroxypentanoic acid
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide