1H-Purine-2,6-dione,7-[3-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]-2-hydroxypropyl]-3,7-dihydro-1,3-dimethyl-
- 中文别名：7-[3-[4-(2-氯苄基)哌嗪-1-基]-2-羟基-丙基]-1,3-二甲基-黄嘌呤
- 英文别名：7-[3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-hydroxypropyl]-1,3-dimethylpurine-2,6-dione;
7-{3-[4-(2-chloro-benzyl)-piperazin-1-yl]-2-hydroxy-propyl}-1,3-dimethyl-3,7-dihydro-purine-2,6-dione;
Theophylline,7-(3-(4-(o-chlorobenzyl)-1-piperazinyl)-2-hydroxypropyl);
7-{3-[4-(2-chlorobenzyl)piperazin-1-yl]-2-hydroxypropyl}-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
- CAS No.：19971-95-0
- 分子式：
C21H27ClN6O3
- 分子量：0
- 精确分子量：446.18300
- PSA：88.53000
- 分子结构式：
物化性质
- 密度：
- 1.42g/cm3
- 沸点：
- 675.8ºC at 760mmHg
- 闪点：
- 362.5ºC
- 折射率：
- 1.679
- 蒸汽压：
- 3.48E-19mmHg at 25°C
安全信息
- 密度：
- 1.42g/cm3
- 沸点：
- 675.8ºC at 760mmHg
- 闪点：
- 362.5ºC
- 折射率：
- 1.679
- 蒸汽压：
- 3.48E-19mmHg at 25°C
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- TL6957000
- CHEMICAL NAME :
- 1-Piperazineethanol, 4-(o-chlorobenzyl)-alpha-(1,3-dimethyl-7-xanthinylmet hyl)-
- CAS REGISTRY NUMBER :
- 19971-95-0
- BEILSTEIN REFERENCE NO. :
- 0595259
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C21-H27-Cl-N6-O3
- MOLECULAR WEIGHT :
- 446.99
- WISWESSER LINE NOTATION :
- T56 BN DN FNVNVJ F1 H1 B1YR BG&- AT6N DNTJ D2Q
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 :
- 121 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Behavioral - excitement
- REFERENCE :
- YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 89,771,1969
