1-(4-丁氧基苯)-3-(1-呱啶基)-1-丙酮 基本信息 | |||
---|---|---|---|
CAS号 | 536-43-6 | 分子式 | C18H28ClNO2 |
分子量 | 325.87300 | 精确质量 | 325.18100 |
PSA | 29.54000 | LogP | 4.66410 |
熔点:175-176°C
沸点:424.5ºC at 760 mmHg
闪点:210.5ºC
存储条件/存储方法:库房通风低温干燥
稳定性相关:
按规格使用和贮存,不会发生分解,避免与氧化物接触
其它信息:
1. 性状:未确定
2. 密度(g/ cm3,25/4℃):未确定
3. 相对蒸汽密度(g/cm3,空气=1):未确定
4. 熔点(ºC):175-176
5. 沸点(ºC,常压):未确定
6. 沸点(ºC,8kPa):未确定
7. 折射率:未确定
8. 闪点(ºC):未确定
9. 比旋光度(º):未确定
10. 自燃点或引燃温度(ºC):未确定
11. 蒸气压(mm Hg,20ºC):未确定
12. 饱和蒸气压(kPa,55.1ºC):未确定
13. 燃烧热(KJ/mol):未确定
14. 临界温度(ºC):未确定
15. 临界压力(KPa):未确定
16. 油水(辛醇/水)分配系数的对数值:未确定
17. 爆炸上限(%,V/V):未确定
18. 爆炸下限(%,V/V):未确定
19. 溶解性:未确定
制备方法
本品为新型高效的镇痛止痒剂,并有相当强的杀菌消炎作用。合成制备方法
暂无
50-00-0
甲醛
+
6091-44-7
哌啶盐酸盐
+
5736-89-0
4-(正丁氧基)苯乙酮
→
536-43-6
1-(4-丁氧基苯)-3-(1-呱啶基)-1-丙酮
用途
用于表面麻醉。
CAS号:536-43-6
3D弹球模型: 立即前往扯扯看
分子式:C18H28ClNO2
分子量:325.87300
中文名称:1-(4-丁氧基苯)-3-(1-呱啶基)-1-丙酮
英文名称:dyclonine hydrochloride
中文别名:1-(4-丁氧基苯)-3-(1-呱啶基)-1-丙酮;
盐酸达克罗宁
英文别名:dyclonine hydrochloride;
Dyclonine Hydrochloride;
4'-BUTOXY-3-PIPERIDINOPROPIOPHENONE HYDROCHLORIDE;
4'-Butoxy-3-piperidinopropiophenone hydrochloride;
Dyclonine hydrochloride;
Dyclone;
Tanaclone;
1-(4-butoxyphenyl)-3-piperidin-1-ylpropan-1-one,hydrochloride;
Dyclocaine hydrochloride;
Dyclothane;
dyclonine HCl
精确分子量/精确质量:325.18100
极性分子表面积/PSA:29.54000
油水分配系数/LogP:
LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:208-633-6
InChI:InChI=1/C18H27NO2.ClH/c1-2-3-15-21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-4-6-13-19;/h7-10H,2-6,11-15H2,1H3;1H
CHEMICAL IDENTIFICATION
RTECS NUMBER :UG8750000
CHEMICAL NAME :Propiophenone, 4'-butoxy-3-piperidino-, hydrochloride
CAS REGISTRY NUMBER :536-43-6
LAST UPDATED :199504
DATA ITEMS CITED :13
MOLECULAR FORMULA :C18-H27-N-O2.Cl-H
MOLECULAR WEIGHT :325.92
WISWESSER LINE NOTATION :T6NTJ A2VR DO4 &GH
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
TYPE OF TEST :Standard Draize test
ROUTE OF EXPOSURE :Administration onto the skin
SPECIES OBSERVED :Rodent - rabbit
REFERENCE :AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962
TYPE OF TEST :Standard Draize test
ROUTE OF EXPOSURE :Administration into the eye
SPECIES OBSERVED :Rodent - rabbit
REFERENCE :AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962
TYPE OF TEST :Standard Draize test
ROUTE OF EXPOSURE :Administration into the eye
SPECIES OBSERVED :Rodent - rabbit
REFERENCE :ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 8,708,1958 ** ACUTE TOXICITY DATA **
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Intraperitoneal
SPECIES OBSERVED :Rodent - rat
DOSE/DURATION :33 mg/kg
TOXIC EFFECTS :Details of toxic effects not reported other than lethal dose value
REFERENCE :ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 8,708,1958
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Subcutaneous
SPECIES OBSERVED :Rodent - rat
DOSE/DURATION :201 mg/kg
TOXIC EFFECTS :Details of toxic effects not reported other than lethal dose value
REFERENCE :JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 115,413,1955
TYPE OF TEST :LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :Oral
SPECIES OBSERVED :Rodent - mouse
DOSE/DURATION :100 mg/kg
TOXIC EFFECTS :Details of toxic effects not reported other than lethal dose value
REFERENCE :TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 2,616,1960
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Intraperitoneal
SPECIES OBSERVED :Rodent - mouse
DOSE/DURATION :52 mg/kg
TOXIC EFFECTS :Details of toxic effects not reported other than lethal dose value
REFERENCE :AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Subcutaneous
SPECIES OBSERVED :Rodent - mouse
DOSE/DURATION :37 mg/kg
TOXIC EFFECTS :Details of toxic effects not reported other than lethal dose value
REFERENCE :ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 8,708,1958
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Intravenous
SPECIES OBSERVED :Rodent - mouse
DOSE/DURATION :20 mg/kg
TOXIC EFFECTS :Behavioral - ataxia Behavioral - muscle contraction or spasticity Behavioral - irritability
REFERENCE :JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 115,419,1955
TYPE OF TEST :LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :Oral
SPECIES OBSERVED :Mammal - dog
DOSE/DURATION :40 mg/kg
TOXIC EFFECTS :Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity Gastrointestinal - nausea or vomiting
REFERENCE :TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 2,616,1960
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Intravenous
SPECIES OBSERVED :Mammal - dog
DOSE/DURATION :9500 ug/kg
TOXIC EFFECTS :Behavioral - tremor Gastrointestinal - changes in structure or function of salivary glands Gastrointestinal - nausea or vomiting
REFERENCE :JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 115,419,1955
TYPE OF TEST :LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :Oral
SPECIES OBSERVED :Rodent - rabbit
DOSE/DURATION :240 mg/kg
TOXIC EFFECTS :Behavioral - ataxia
REFERENCE :TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 2,616,1960 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4641 No. of Facilities: 15 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 197 (estimated) No. of Female Employees: 136 (estimated)
毒理学数据:
1、皮肤/眼睛刺激数据:标准Draize测试兔子直接接触皮肤:1%REACTION SEVERITY:轻度;
标准Draize测试兔子直接接触眼睛:1%REACTION SEVERITY:轻度;
标准Draize测试兔子直接接触眼睛:2%REACTION SEVERITY:严重;
2、急性毒性:大鼠经腹腔LD50:33mg/kg,除致死剂量外无详细说明;
大鼠经皮下LD50:201mg/kg,除致死剂量外无详细说明;
小鼠经口LDLo:100mg/kg,除致死剂量外无详细说明;
小鼠经腹腔LD50:52mg/kg,除致死剂量外无详细说明;
小鼠经皮下LD50:37mg/kg,除致死剂量外无详细说明;
小鼠经静脉LD50:20mg/kg,行为-共济失调,肌肉收缩或痉挛,烦躁;
狗经口LDLo:40mg/kg,行为-惊厥或癫痫,肌肉收缩或痉挛,胃肠道-恶心或呕吐;
狗经静脉LD50:9500ug/kg,颤抖,胃肠、唾液腺结构或功能的变化,恶心或呕吐;
兔子经口LD50:240mg/kg,行为-共济失调。
生态数据:
该物质对环境可能有危害,对水体应给予特别注意。
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:3
4.可旋转化学键数量:8
5.互变异构体数量:2
6.拓扑分子极性表面积29.5
7.重原子数量:22
8.表面电荷:0
9.复杂度:292
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
安全信息
包装等级:III
风险类别:6.1(b)
海关代码:2942000000
WGK_Germany:3
德国有关水污染物质的分类清单
危险类别码:R22
安全说明:S26-S36
RTECS号:UG8750000
安全标志:S26:万一接触眼睛,立即使用大量清水冲洗并送医诊治。
S36:穿戴合适的防护服装。
危险标志:Xn: Harmful;
海关信息
声明:该栏目及页面中图片、产品参数数据来源于互联网,仅供用于参考了解化学品信息,不等同凯茵化工实际销售产品。
颜料黄BH-R4005-08
DPP红-D2005-08
喹吖啶酮红117105-08
德固赛无定型聚烯烃纺织造纸包装工业热熔胶12-19
迪高LTW-B附着力促进树脂06-05
何谓功能性丙烯酸类单体?主要用于何种场合09-11
日元的贬值将引发新一轮胶产品的价格上涨06-17
三菱热塑性丙烯酸树脂LR-762712-10