阿莫地喹

外观与性状：

水晶般的固体

密度：

1.258

熔点：

208°C

沸点：

478ºC at 760 mmHg

闪点：

242.9ºC

海关代码：

2933499090

WGK_Germany：

3
德国有关水污染物质的分类清单

安全说明：

S22-S24/25-S8

CHEMICAL IDENTIFICATION

RTECS NUMBER :

GO7300000

CHEMICAL NAME :

o-Cresol, 4-((7-chloro-4-quinolyl)amino)-alpha-(diethylamino)-

CAS REGISTRY NUMBER :

86-42-0

BEILSTEIN REFERENCE NO. :

0300962

LAST UPDATED :

199612

DATA ITEMS CITED :

7

MOLECULAR FORMULA :

C20-H22-Cl-N3-O

MOLECULAR WEIGHT :

355.90

WISWESSER LINE NOTATION :

T66 BNJ EMR DQ C1N2&2& IG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :

LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Human - woman

DOSE/DURATION :

72 mg/kg/7W-I

TOXIC EFFECTS :

Lungs, Thorax, or Respiration - pulmonary emboli Liver - other changes Blood - agranulocytosis

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Human - man

DOSE/DURATION :

20 mg/kg/25D-I

TOXIC EFFECTS :

Blood - thrombocytopenia

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Human - woman

DOSE/DURATION :

29 mg/kg/25D-I

TOXIC EFFECTS :

Blood - thrombocytopenia

TYPE OF TEST :

LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

800 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 :

Oral

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

550 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 :

225 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :

Phage inhibition capacity

TEST SYSTEM :

Bacteria - Escherichia coli

DOSE/DURATION :

5 mg/plate

REFERENCE :

MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 222,311,1989

中国海关编码：2933499090

概述：

2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素：

品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

摘要/Summary：

2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

分子结构数据

1、  摩尔折射率：105.50

2、  摩尔体积（cm³/mol）：282.7

3、  等张比容（90.2K）：771.1

4、  表面张力（dyne/cm）：55.2

5、  极化率（10-24cm3）：41.82

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:4

4.可旋转化学键数量:6

5.互变异构体数量:13

6.拓扑分子极性表面积48.4

7.重原子数量:25

8.表面电荷:0

9.复杂度:406

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:1