Xanthine, 1,3-dimethyl-8-ethyl-

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Names

[ CAS No. ]:
5770-28-5

[ Name ]:
Xanthine, 1,3-dimethyl-8-ethyl-

[Synonym ]:
8-Ethyltheophylline
8-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
Theophylline,8-ethyl
Xanthine,1,3-dimethyl-8-ethyl
8-Aethyl-1,3-dimethyl-3,7-dihydro-purin-2,6-dion
1,3-dimethyl-8-ethylxanthine
8-ethyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione

Chemical & Physical Properties

[ Density]:
1.337g/cm3

[ Boiling Point ]:
461.5ºC at 760 mmHg

[ Molecular Formula ]:
C9H12N4O2

[ Molecular Weight ]:
208.21700

[ Flash Point ]:
232.9ºC

[ Exact Mass ]:
208.09600

[ PSA ]:
72.68000

[ Index of Refraction ]:
1.592

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5200000
CHEMICAL NAME :
Theophylline, 8-ethyl-
CAS REGISTRY NUMBER :
5770-28-5
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H12-N4-O2
MOLECULAR WEIGHT :
208.25
WISWESSER LINE NOTATION :
T56 BM DN FNVNVJ C2 F1 H1

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 :
175 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 14,1202,1971

Related Compounds

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(2,3-dihydroxypropyl)-1,3-dimethyl- 8-(ethyl(phenylmethyl)amino)-
  • 3,7-Dihydro-8-(4-hydroxybutyl)-1,3-dimethyl-1H-purine-2,6-dione
  • 8-Pentyltheophyline
  • 1,3-dimethyl-8-(2-methylpropyl)-7H-purine-2,6-dione
  • 1H-Purine-2,6-dione, 8-hexyl-3,7-dihydro-1,3-dimethyl- (9CI)
  • 1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-propyl-