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安非他酮

CAS 34841-39-9C13H18ClNOMW 239.74

安非他酮(CAS 34841-39-9):分子式 C13H18ClNO、分子量 239.74。

产品概览

CAS号34841-39-9
分子式C13H18ClNO
分子量239.74
熔点233-234 °C
沸点BP: 52 °C at 0.005 mm Hg
LogP3.6
应用领域Uses: Antidepressive Agents、Second-Generation、Dopamine Uptake Inhibitors、MEDICATION、Use (kg、approx.) in Germany (2009): >1000、Use (kg) in USA (2002): 147000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Consumption (g per capita) in the USA (2002): 0.521、Excretion rate: 0.005、Calculated removal (%): 59.3、For the treatment of depression and as aid to smoking cessation.、Use Classification: Pharmaceuticals、Methods of Manufacturing: m-Chlorobenzonitrile is reacted with ethyl Grignard reagent in ether to produce m-chlorobenzyl ethyl ketone、which is brominated in dichloromethane. The product is reacted with tertiary butyl amine in acetonitrile to yield bupropion base. Treatment of an ethereal solution of the base with dry HCl yields the salt.、Preparation: N. B. Mehta、D. A. Yeowell、German patent 2059618 (1971 to Wellcome Found.)、N. B. Mehta、United States of America patent 3819706 (1974 to Burroughs Wellcome).、Formulations、Preparations: Oral: extended release tablets、174 mg、348 mg、552 mg、Aplenzin (Sanofi-Aventis).、Bupropion hydrobromide、Table: Bupropion Hydrochloride Preparations [Table#6565]

应用领域

登记用途:Uses: Antidepressive Agents、Second-Generation、Dopamine Uptake Inhibitors、MEDICATION、Use (kg、approx.) in Germany (2009): >1000、Use (kg) in USA (2002): 147000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Consumption (g per capita) in the USA (2002): 0.521、Excretion rate: 0.005、Calculated removal (%): 59.3、For the treatment of depression and as aid to smoking cessation.、Use Classification: Pharmaceuticals、Methods of Manufacturing: m-Chlorobenzonitrile is reacted with ethyl Grignard reagent in ether to produce m-chlorobenzyl ethyl ketone、which is brominated in dichloromethane. The product is reacted with tertiary butyl amine in acetonitrile to yield bupropion base. Treatment of an ethereal solution of the base with dry HCl yields the salt.、Preparation: N. B. Mehta、D. A. Yeowell、German patent 2059618 (1971 to Wellcome Found.)、N. B. Mehta、United States of America patent 3819706 (1974 to Burroughs Wellcome).、Formulations、Preparations: Oral: extended release tablets、174 mg、348 mg、552 mg、Aplenzin (Sanofi-Aventis).、Bupropion hydrobromide、Table: Bupropion Hydrochloride Preparations [Table#6565]。

技术档案

这个产品是什么

安非他酮 是一种化工化合物,登记 CAS 号为 34841-39-9,分子式 C13H18ClNO(分子量 239.74)。

识别信息

登记 CAS 号:34841-39-9

其分子式 C13H18ClNO 由 13 个碳、18 个氢、1 个氯、1 个氮、1 个氧 组成。

别名/同义词:安非他酮 · Bupropion

常见问题

安非他酮 的 CAS 号是多少?

安非他酮 的 CAS 登记号为 34841-39-9。

安非他酮 的分子式与分子量是多少?

分子式 C13H18ClNO,分子量 239.74。

安非他酮 还有哪些别名?

别名/同义词:安非他酮、Bupropion。

安非他酮 的登记用途是什么?

登记用途:Uses: Antidepressive Agents、Second-Generation、Dopamine Uptake Inhibitors、MEDICATION、Use (kg、approx.) in Germany (2009): >1000、Use (kg) in USA (2002): 147000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Consumption (g per capita) in the USA (2002): 0.521、Excretion rate: 0.005、Calculated removal (%): 59.3、For the treatment of depression and as aid to smoking cessation.、Use Classification: Pharmaceuticals、Methods of Manufacturing: m-Chlorobenzonitrile is reacted with ethyl Grignard reagent in ether to produce m-chlorobenzyl ethyl ketone、which is brominated in dichloromethane. The product is reacted with tertiary butyl amine in acetonitrile to yield bupropion base. Treatment of an ethereal solution of the base with dry HCl yields the salt.、Preparation: N. B. Mehta、D. A. Yeowell、German patent 2059618 (1971 to Wellcome Found.)、N. B. Mehta、United States of America patent 3819706 (1974 to Burroughs Wellcome).、Formulations、Preparations: Oral: extended release tablets、174 mg、348 mg、552 mg、Aplenzin (Sanofi-Aventis).、Bupropion hydrobromide、Table: Bupropion Hydrochloride Preparations [Table#6565]。

PubChem 公开数据

安非他酮(CAS 34841-39-9)的独立参考数据,整理自公开化学数据库。

各数据库的登记标识

CAS 号34841-39-9
PubChem CID444
分子式C13H18ClNO
IUPAC 名称2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one
UNII(FDA)01ZG3TPX31

计算分子描述符

Molecular Weight239.74
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass239.1076919
Monoisotopic Mass239.1076919
Topological Polar Surface Area29.1
Heavy Atom Count16

在册的理化数值

Boiling PointBP: 52 °C at 0.005 mm Hg
Melting Point233-234 °C
Solubility312
LogP3.6
LogP3.0
Dissociation Constants8.35
Dissociation Constants8.2

同义词与商品名

bupropion; Amfebutamone; 34911-55-2; 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one; Amfebutamon; amfebutamonum; Amfebutamona; (+-)-Bupropion; Elontril; Bupropion slow release; bupropione; Bupropion extended release; alpha-(tert-butylamino)-m-chloropropiophenone; 01ZG3TPX31; NSC-758686; (+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone

GHS 危害分类

已通报的危害声明H302

公开数据库对它的描述

安非他酮 · CAS 34841-39-9 · C13H18ClNO. UNII 01ZG3TPX31. Boiling Point: BP: 52 °C at 0.005 mm Hg; Melting Point: 233-234 °C; Solubility: 312.

数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。

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