依利醋铵

  • 基本信息
  • 毒理性
  • 结构与计算化学
  • 下游产品

依利醋铵 基本信息

中文名称:
依利醋铵 
中文别名:
依利醋铵 
英文名称:
elliptinium acetate
英文别名:
2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-ol,acetate;
ELLIPTINIUM ACETATE;
Ellipticine acetomethylate;
9-hydroxy-2-methylellipticinium acetate;
elliptinium;
Elliptinii acetas [INN-Latin];
EINECS 261-216-0;
Acetato de eliptinio [INN-Spanish];
Acetate d'elliptinium [INN-French];
Celiptium;
9-hydroxy-N-2-methylellipticinium acetate;
Elliptinium acetate [INN:BAN];
N2-Methylhydroxyellipticinium acetate;
N2-methyl-9-hydroxyellipticinium acetate 
CAS No.:
58337-35-2
分 子 式:
C20H20N2O3
分 子 量:
336.3844
精确分子量:
336.14700
PSA:
80.03000
EINECS:
261-216-0
InChI:
The Key: BOMZMNZEXMAQQW-UHFFFAOYSA-N
分子结构式:
SDS:
查看

依利醋铵 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU8875500
CHEMICAL NAME :
6H-Pyrido(4,3-b)carbazolium, 9-hydroxy-2,5,11-trimethyl-, acetate
CAS REGISTRY NUMBER :
58337-35-2
LAST UPDATED :
199609
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C18-H17-N2-O.C2-H3-O2
MOLECULAR WEIGHT :
336.42

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
33 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
18 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10200 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
8 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
40 mg/kg/8W-I
TOXIC EFFECTS :
Kidney, Ureter, Bladder - changes in tubules (including acute renal failure, acute tubular necrosis) Kidney, Ureter, Bladder - changes in bladder weight Nutritional and Gross Metabolic - weight loss or decreased weight gain
TYPE OF TEST :
Micronucleus test

MUTATION DATA

TEST SYSTEM :
Rodent - mouse
DOSE/DURATION :
10 mg/kg
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 89,281,1987

依利醋铵 分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:2

3.氢键受体数量:3

4.可旋转化学键数量:0

5.互变异构体数量:71

6.拓扑分子极性表面积:80

7.重原子数量:25

8.表面电荷:0

9.复杂度:426

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:2

依利醋铵 下游产品

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