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100-92-5生产厂家

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100-92-5

100-92-5结构式
100-92-5结构式

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中文名 美芬丁胺
英文名 N,2-dimethyl-1-phenylpropan-2-amine
中文别名 N,2-二甲基-1-苯基丙-2-胺
恢压敏
英文别名 Wyfentermina
Mephine
(1,1-dimethyl-2-phenyl-ethyl)-methyl-amine
Mefentermin
Mephenterdrine
Wyamine
Mephenterdrinum
Mephentermine
Mefenterdrin
N-Methyl-N-(1,1-dimethyl-phenaethyl)-amin
Vialin
2-Methylamino-2-methyl-1-phenyl-propan
(1,1-Dimethyl-2-phenyl-aethyl)-methyl-amin
Mephetedrine
EINECS 202-901-6
密度 0.903g/cm3
沸点 229.4ºC at 760mmHg
分子式 C11H17N
分子量 163.25900
闪点 90ºC
精确质量 163.13600
PSA 12.03000
LogP 2.61800
蒸汽压 0.0697mmHg at 25°C
折射率 1.501
分子结构

1、 摩尔折射率:53.26

2、 摩尔体积(cm3/mol):180.6

3、 等张比容(90.2K):426.2

4、 表面张力(dyne/cm):31.0

5、 极化率(10-24cm3):21.11

计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:1

4.可旋转化学键数量:3

5.互变异构体数量:无

6.拓扑分子极性表面积12

7.重原子数量:12

8.表面电荷:0

9.复杂度:123

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SI3675000
CHEMICAL NAME :
Phenethylamine, N,alpha,alpha-trimethyl-
CAS REGISTRY NUMBER :
100-92-5
BEILSTEIN REFERENCE NO. :
1363850
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C11-H17-N
MOLECULAR WEIGHT :
163.29
WISWESSER LINE NOTATION :
1MX1&1&1R

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 :
85 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - tremor Behavioral - excitement
REFERENCE :
ZPPLBF Zentralblatt fuer Pharmazie, Pharmakotherapie und Laboratoriums-diagnostik. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, 102 Berlin, Ger. Dem. Rep.) V.109- 1970- Volume(issue)/page/year: 111,169,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
13 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - tremor Behavioral - excitement
REFERENCE :
ZPPLBF Zentralblatt fuer Pharmazie, Pharmakotherapie und Laboratoriums-diagnostik. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, 102 Berlin, Ger. Dem. Rep.) V.109- 1970- Volume(issue)/page/year: 111,169,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
57 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - tremor Behavioral - excitement
REFERENCE :
ZPPLBF Zentralblatt fuer Pharmazie, Pharmakotherapie und Laboratoriums-diagnostik. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, 102 Berlin, Ger. Dem. Rep.) V.109- 1970- Volume(issue)/page/year: 111,169,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
89 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - tremor Behavioral - excitement
REFERENCE :
ZPPLBF Zentralblatt fuer Pharmazie, Pharmakotherapie und Laboratoriums-diagnostik. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, 102 Berlin, Ger. Dem. Rep.) V.109- 1970- Volume(issue)/page/year: 111,169,1972
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
43 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - tremor Behavioral - excitement
REFERENCE :
ZPPLBF Zentralblatt fuer Pharmazie, Pharmakotherapie und Laboratoriums-diagnostik. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, 102 Berlin, Ger. Dem. Rep.) V.109- 1970- Volume(issue)/page/year: 111,169,1972

海关编码 2921499090

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100-92-5结构式

100-92-5

文献:Journal of the American Chemical Society, , vol. 70, p. 955

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100-92-5结构式

100-92-5

文献:Journal of the American Chemical Society, , vol. 70, p. 955

~%

100-92-5结构式

100-92-5

文献:Journal of the American Chemical Society, , vol. 70, p. 955

~%

100-92-5结构式

100-92-5

文献:US2597445 , ;

~%

100-92-5结构式

100-92-5

文献:US2700681 , ;

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100-92-5结构式

100-92-5

文献:Journal of pharmaceutical sciences, , vol. 55, # 1 p. 38 - 43
海关编码 2921499090
中文概述 2921499090 其他芳香单胺及衍生物及它们的盐. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素 品名, 成分含量, 用途
Summary 2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%