3,7-二甲基-1-(2-甲基烯丙基)-1H-嘌呤-2,6(3H,7H)-二酮

  • 基本信息
  • 物化性质
  • 毒理性

3,7-二甲基-1-(2-甲基烯丙基)-1H-嘌呤-2,6(3H,7H)-二酮 基本信息

中文名称:
3,7-二甲基-1-(2-甲基烯丙基)-1H-嘌呤-2,6(3H,7H)-二酮 
中文别名:
3,7-dimethyl-1-(2-methylprop-2-enyl)purine-2,6-dione 
英文名称:
1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-methyl-2-propen-1-yl)-
英文别名:
3,7-dimethyl-1-(2-methylprop-2-enyl)purine-2,6-dione;
1-(2'-Methylallyl)theobromine;
3,7-Dimethyl-1-(2-methylallyl)-1H-purine-2,6(3H,7H)-dione 
CAS No.:
63906-62-7
分 子 式:
C11H14N4O2
分 子 量:
0
精确分子量:
234.11200
PSA:
61.82000
分子结构式:
SDS:
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3,7-二甲基-1-(2-甲基烯丙基)-1H-嘌呤-2,6(3H,7H)-二酮 物化性质

密度:
1.29g/cm3
沸点:
437.9ºC at 760 mmHg
闪点:
218.7ºC
折射率:
1.625

3,7-二甲基-1-(2-甲基烯丙基)-1H-嘌呤-2,6(3H,7H)-二酮 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH2470000
CHEMICAL NAME :
Theobromine, 1-(2'-methylallyl)-
CAS REGISTRY NUMBER :
63906-62-7
LAST UPDATED :
199009
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-N4-O2
MOLECULAR WEIGHT :
234.29
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B1 F1 H1UY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
254 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
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: 86,113,1946

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