1-Propyl-3-butyl-8-methylxanthine

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Names

[ CAS No. ]:
81250-24-0

[ Name ]:
1-Propyl-3-butyl-8-methylxanthine

[Synonym ]:
1-Propyl-3-butyl-8-methylxanthine
1H-Purine-2,6-dione,3,7-dihydro-3-butyl-8-methyl-1-propyl
3,7-Dihydro-3-butyl-8-methyl-1-propyl-1H-purine-2,6-dione

Chemical & Physical Properties

[ Density]:
1.18g/cm3

[ Boiling Point ]:
484.4ºC at 760 mmHg

[ Molecular Formula ]:
C13H20N4O2

[ Molecular Weight ]:
264.32400

[ Flash Point ]:
246.8ºC

[ Exact Mass ]:
264.15900

[ PSA ]:
72.68000

[ LogP ]:
1.40480

[ Index of Refraction ]:
1.548

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO8412784
CHEMICAL NAME :
1H-Purine-2,6-dione, 3,7-dihydro-3-butyl-8-methyl-1-propyl-
CAS REGISTRY NUMBER :
81250-24-0
LAST UPDATED :
199806
DATA ITEMS CITED :
2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
15 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4581451
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
91 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4581451

Related Compounds

  • 1-Allyl-3-butyl-8-methylxanthine
  • (1-propyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)methanol
  • 1-propyl-3,4-dihydro-1H-quinoxalin-2-one
  • 1-propyl-3-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]urea
  • 1-propyl-3,1-benzoxazine-2,4-dione
  • 1,3-Diisobutyl-8-methylxanthine