阿齐美克
- 中文名称：
- 阿齐美克
- 中文别名：
- 阿齐美克
- 英文名称：
- 2-Aziridinecarboxamide,1-[1-(2-cyano-1-aziridinyl)-1-methylethyl]-
- 英文别名：
- 1-[2-(2-cyanoaziridin-1-yl)propan-2-yl]aziridine-2-carboxamide;
2-(2-Cyan-aziridin-1-yl)-2-(2-carbamoyl-aziridin-1-yl)-propan;
Azimexon;
azimexone;
Azimexonum [INN-Latin];
Azimexona [Spanish];
Azimexone [Polish];
Azimexona [INN-Spanish];
2-(2-Cyan-aziridinyl-1)-2-(2-carbamoyl-aziridinyl-1)-propan;
1-[1-(2-cyano-aziridin-1-yl)-1-methyl-ethyl]-aziridine-2-carboxylic acid amide;
EINECS 264-679-7;
2-(2-carbamoyl-aziridino)-2-(2-cyano-aziridino)-cyclohexane
- CAS No.：
- 64118-86-1
- 分 子 式：
-
C9H14N4O
- 分 子 量：
- 0
- 精确分子量：
- 194.11700
- PSA：
- 72.90000
- EINECS：
- 264-679-7
- InChI：
- The Key: RPZOFMHRRHHDPZ-UHFFFAOYSA-N3
- 分子结构式：
-
- SDS：
- 查看
阿齐美克 物化性质
- 密度：
- 1.29g/cm3
- 沸点：
- 403.4ºC at 760 mmHg
- 闪点：
- 197.8ºC
- 折射率：
- 1.598
阿齐美克 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CM6754000
- CHEMICAL NAME :
- 2-Aziridinecarboxamide,
1-(1-(2-cyano-1-aziridinyl)-1-methylethyl)-
- CAS REGISTRY NUMBER :
- 64118-86-1
- BEILSTEIN REFERENCE NO. :
- 0476876
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C9-H14-N4-O
- MOLECULAR WEIGHT :
- 194.27
- WISWESSER LINE NOTATION :
- T3NTJ BVZ AX1&1&- AT3NTJ BCN
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 3100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- USXXAM United States Patent Document. (U.S. Patent Office, Box 9,
Washington, DC 20231) Volume(issue)/page/year: #4370323
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2550 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- USXXAM United States Patent Document. (U.S. Patent Office, Box 9,
Washington, DC 20231) Volume(issue)/page/year: #4370323
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1400 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540,
08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year:
5,174,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 560 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- AITEAT Archivum Immunologiae et Therapiae Experimentalis. (Ars Polona, POB
1001, 00-068 Warsaw 1, Poland) V.10- 1962- Volume(issue)/page/year:
34,333,1986
阿齐美克 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）:-0.6
2.氢键供体数量:1
3.氢键受体数量:4
4.可旋转化学键数量:3
5.互变异构体数量:3
6.拓扑分子极性表面积:72.9
7.重原子数量:14
8.表面电荷:0
9.复杂度:329
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:2
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
