恩普氨酯
- 中文名称：
- 恩普氨酯
- 中文别名：
- 恩普氨酯;
英普罗马
- 英文名称：
- Carbamic acid,N-cyclohexyl-, 1,1-diphenyl-2-propyn-1-yl ester
- 英文别名：
- 1,1-diphenylprop-2-ynyl N-cyclohexylcarbamate;
N-Cyclohexyl-carbamidsaeure-(1,1-diphenyl-propin-(2)-ylester);
Enpromatum [INN-Latin];
Empromate;
ENPROMATE;
Acetylenic carbamate;
Empromato [INN-Spanish];
1,1-Diphenyl-2-propynyl cyclohexylcarbamate;
1,1-Diphenyl-2-propynylcyclophosphamide;
Enpromate [USAN:INN];
1,1-Diphenyl-2-propinyl-cyclohexylcarbamat
- CAS No.：
- 10087-89-5
- 分 子 式：
-
C22H23NO2
- 分 子 量：
- 333.46
- 精确分子量：
- 333.17300
- PSA：
- 38.33000
- InChI：
- The Key: NBEALWAVEGMZQY-UHFFFAOYSA-N3
- 安全术语：
- Poison by intraperitoneal route. Moderately toxic by ingestion. Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also CARBAMATES.
- 分子结构式：
-
- SDS：
- 查看
恩普氨酯 物化性质
- 密度：
- 1.14g/cm3
- 沸点：
- 476.9ºC at 760mmHg
- 闪点：
- 242.2ºC
- 折射率：
- 1.595
- 蒸汽压：
- 2.94E-09mmHg at 25°C
恩普氨酯 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- GU7175000
- CHEMICAL NAME :
- Cyclohexanecarbamic acid, 1,1-diphenyl-2-propynyl
ester
- CAS REGISTRY NUMBER :
- 10087-89-5
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 13
- MOLECULAR FORMULA :
- C22-H23-N-O2
- MOLECULAR WEIGHT :
- 333.46
- WISWESSER LINE NOTATION :
- L6TJ AMVOXR&R&1U1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/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 :
- 374 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- >250 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 :
- Primate - monkey
- DOSE/DURATION :
- >250 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 :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1690 mg/kg/27W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria
Gastrointestinal - tumors
Skin and Appendages - tumors
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 31500 mg/kg/67W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria
Cardiac - tumors
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1925 mg/kg/11W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria
Gastrointestinal - tumors
Skin and Appendages - tumors
- TYPE OF TEST :
- TD - Toxic dose (other than lowest)
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 13600 mg/kg/40W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria
Cardiac - tumors
Gastrointestinal - tumors
MUTATION DATA
- TYPE OF TEST :
- Unscheduled DNA synthesis
- TEST SYSTEM :
- Rodent - rat Liver
- DOSE/DURATION :
- 10 umol/L
- REFERENCE :
- ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For
publisher information, see EMMUEG. Volume(issue)/page/year: 3,11,1981
恩普氨酯 海关数据
中国海关编码：2924299090
- 概述：
- 2924299090. 其他环酰胺（包括环氨基甲酸酯）（包括其衍生物以及他们的盐）. 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:30.0%
- 申报要素：
- 品名, 成分含量, 用途, 包装
- 摘要/Summary：
- 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
恩普氨酯 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）:5
2.氢键供体数量:1
3.氢键受体数量:2
4.可旋转化学键数量:6
5.互变异构体数量:2
6.拓扑分子极性表面积:38.3
7.重原子数量:25
8.表面电荷:0
9.复杂度:456
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
