5-Isopropenyl-5-pentylbarbituric acid

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Names

[ CAS No. ]:
67051-36-9

[ Name ]:
5-Isopropenyl-5-pentylbarbituric acid

[Synonym ]:
5-isopropenyl-5-pentyl-barbituric acid
5-Isopropenyl-5-pentyl-barbitursaeure
BARBITURIC ACID,5-ISOPROPENYL-5-PENTYL

Chemical & Physical Properties

[ Density]:
1.087g/cm3

[ Molecular Formula ]:
C12H18N2O3

[ Molecular Weight ]:
238.28300

[ Exact Mass ]:
238.13200

[ PSA ]:
75.27000

[ LogP ]:
2.15280

[ Index of Refraction ]:
1.478

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ7083000
CHEMICAL NAME :
Barbituric acid, 5-isopropenyl-5-pentyl-
CAS REGISTRY NUMBER :
67051-36-9
BEILSTEIN REFERENCE NO. :
0225364
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H18-N2-O3
MOLECULAR WEIGHT :
238.32
WISWESSER LINE NOTATION :
T6VMVMV FHJ FY1&U1 F5

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
470 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 61,96,1939
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
350 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 61,96,1939

Related Compounds

  • 5,5-Diethyl-1-pentylbarbituric acid
  • 5-Ethyl-1-methyl-5-pentylbarbituric acid
  • 5-(2-Methyl-2-propenyl)-5-pentylbarbituric acid
  • (4R,5R)-4-Benzyl-5-isopropenyl-5-methyl-2-oxo-oxazolidine-3-carboxylic acid tert-butyl ester
  • BARBITURIC ACID, 5-BUTYL-5-ISOPROPENYL-
  • BARBITURIC ACID, 5-ALLYL-5-ISOPROPENYL-