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2850-41-1

2850-41-1 structure
2850-41-1 structure

Name 1,3-dimethyl-8-propyl-7H-purine-2,6-dione
Synonyms 8-n-Propyl theophylline
3,7-Dihydro-1,3-dimethyl-8-propyl-1H-purine-2,6-dione
1,3-dimethyl-8-propyl-3,7-dihydro-purine-2,6-dione
1,3-Dimethyl-8-propyl-3,7-dihydro-purin-2,6-dion
8-Propyltheophylline
Xanthine,1,3-dimethyl-8-propyl
8-propyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
Theophylline,8-propyl
1,3-dimethyl-8-(n-propyl)xanthine
1,3-dimethyl-8-propylxanthine
1,3-dimethyl-8-propyl-3,7(9)-dihydro-purine-2,6-dione
Density 1.29g/cm3
Boiling Point 463.9ºC at 760 mmHg
Molecular Formula C10H14N4O2
Molecular Weight 222.24400
Flash Point 234.4ºC
Exact Mass 222.11200
PSA 72.68000
Vapour Pressure 8.73E-09mmHg at 25°C
Index of Refraction 1.58

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH6492000
CHEMICAL NAME :
Theophylline, 8-propyl-
CAS REGISTRY NUMBER :
2850-41-1
BEILSTEIN REFERENCE NO. :
0218784
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H14-N4-O2
MOLECULAR WEIGHT :
222.28
WISWESSER LINE NOTATION :
T56 BM DN FNVNVJ C3 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 :
250 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
HS Code 2933990090
HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%