7-Butyltheophylline 7-丁基-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮

CAS 1021-65-4 MFCD01682354

化学结构图

1021-65-4
SMILES: CCCCn1cnc2c1c(=O)n(C)c(=O)n2C

化学属性

Mol. FormulaC11H16N4O2
Mol. Weight236.27

别名和识别编码

Chemical Name7-Butyltheophylline
Synonym 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione 7-Butyltheophylline {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Butyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
CAS Number1021-65-4
Beilstein Registry Number0250158
PubChem Substance ID70557
InChIInChI=1S/C11H16N4O2/c1-4-5-6-15-7-12-9-8(15)10(16)14(3)11(17)13(9)2/h7H,4-6H2,1-3H3
Chemical Name Translation 7-丁基-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮
Canonical SMILESO=C1C2=C(N=CN2CCCC)N(C(=O)N1C)C
MDL NumberMFCD01682354
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安全信息

RTECSXH4999000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 272 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 116,343,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 617 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 116,343,1956

Storage condition

系列性分类

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