4-氨基吡啶盐酸盐
- 中文名称：
- 4-氨基吡啶盐酸盐
- 中文别名：
- 4-氨基吡啶
- 英文名称：
- tert-Butyl 4-?(2-?ethoxy-?2-?oxoethyl)?piperidine-?1-?carboxylate
- 英文别名：
- pyridin-4-amine,hydrochloride;
4-Pyridinamine hydrochloride;
4-aminopyridinium chloride;
Pyridine,4-amino-,hydrochloride;
4-Aminopyridine hydrochloride;
4-Pyridinamine,monohydrochloride;
4-pyridinamine,hydrochloride(1:1)
- CAS No.：
- 1003-40-3
- 分 子 式：
-
C14H25NO4
- 分 子 量：
- 271.353
- 精确分子量：
- 130.03000
- PSA：
- 38.91000
- InChI：
- The Key: CBFZWGRQXZYRRR-UHFFFAOYSA-N3
- SDS：
- 查看
4-氨基吡啶盐酸盐 物化性质
- 沸点：
- 255.2ºC at 760mmHg
- 闪点：
- 131.8ºC
- 蒸汽压：
- 0.0165mmHg at 25°C
- 存储条件/存储方法：
- 库房通风低温干燥
4-氨基吡啶盐酸盐 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- US1821000
- CHEMICAL NAME :
- Pyridine, 4-amino-, hydrochloride
- CAS REGISTRY NUMBER :
- 1003-40-3
- LAST UPDATED :
- 199106
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C5-H6-N2.Cl-H
- MOLECULAR WEIGHT :
- 130.59
- WISWESSER LINE NOTATION :
- T6NJ DZ &GH
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 :
- 32 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PCONAI Pest Control. (Harcourt Brace Jovanovich, 1 E. 1st St., Duluth, MN
55802) V.17- 1949- Volume(issue)/page/year: 33,16,1965
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 10130 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EKMMA8 Eksperimentalna Meditsina i Morfologiya. (Hemus, Blvd. Russki 6,
Sofia, Bulgaria) V.1- 1962- Volume(issue)/page/year: 18,98,1979
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 6700 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und
Pharmakologie. (Berlin, Ger.) V.110-253, 1925-66. For publisher
information, see NSAPCC. Volume(issue)/page/year: 236,149,1959
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 11900 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EKMMA8 Eksperimentalna Meditsina i Morfologiya. (Hemus, Blvd. Russki 6,
Sofia, Bulgaria) V.1- 1962- Volume(issue)/page/year: 18,98,1979
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 2377 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JWMAA9 Journal of Wildlife Management. (Wildlife Soc., 5410 Grosvenor Lane,
Bethesda, MD 20814) V.1- 1937- Volume(issue)/page/year: 29,830,1965
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 327 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 34ZIAG "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York,
Academic Press, Inc., 1969 Volume(issue)/page/year: -,93,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - pig
- DOSE/DURATION :
- 3547 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JWMAA9 Journal of Wildlife Management. (Wildlife Soc., 5410 Grosvenor Lane,
Bethesda, MD 20814) V.1- 1937- Volume(issue)/page/year: 29,830,1965
4-氨基吡啶盐酸盐 海关数据
中国海关编码：2933399090
- 概述：
- 2933399090. 其他结构含非稠合吡啶环的化合物. 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：
- 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
4-氨基吡啶盐酸盐 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:2
4.可旋转化学键数量:0
5.互变异构体数量:2
6.拓扑分子极性表面积:38.9
7.重原子数量:8
8.表面电荷:0
9.复杂度:48
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