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61444-26-6

61444-26-6结构式
61444-26-6结构式

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英文名 1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
英文别名 Theophylline,7-allyl
N-allyltheophyllin
N7-Allyltheophylline
N5-allyl-1,3-dimethylxanthine
N-allyltheophylline
7-Allyltheophylline
7-Allyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(2-propenyl)
7-allyl-1,3-dimethylxanthine
密度 1.32g/cm3
沸点 426.1ºC at 760 mmHg
分子式 C10H12N4O2
分子量 220.22800
闪点 211.5ºC
精确质量 220.09600
PSA 61.82000
折射率 1.638

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH3859550
CHEMICAL NAME :
Theophylline, 7-allyl-
CAS REGISTRY NUMBER :
61444-26-6
BEILSTEIN REFERENCE NO. :
0226015
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H12-N4-O2
MOLECULAR WEIGHT :
220.26

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 :
315 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
299 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