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苯甲醯艾克寧

苯甲醯艾克寧

CAS号：519-09-5

英文名：ecgonine benzoate

分子式

C16H19NO4

熔点

195ºC

密度

1.29 g/cm3

分子量

289.326

沸点

442.4ºC at 760 mmHg

溶解度

信号词

危险品标志

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化合物简介

Benzoyl Ecgonine, is a metabolite of Cocaine.\nControlled substance.

基本信息

中文名称

苯甲醯艾克寧

英文名称

ecgonine benzoate

中文别名

苯甲酰芽子碱

英文别名

O-Benzoylecgonin、Benzoylecognine、8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, [1R-(exo,exo)]-、Benzoylecogonine、Ecgonine benzoate、BENZOYLECGONINE、benzylecgonine、benzoylecgonine solution、Benzoylecgonine tetrahydrate、benzoylecgonine methanol solution

CAS号

519-09-5

分子式

C16H19NO4

分子量

289.326

精确质量

289.131

PSA

66.84

LOGP

1.7172

编号系统

UNII

5353I8I6YS

物化性质

外观与性状

结晶固体

密度

1.29 g/cm3

沸点

442.4ºC at 760 mmHg

熔点

195ºC

闪点

221.4ºC

折射率

1.599

储存条件

2-8ºC

安全信息

安全说明

S16; S36/37; S45

危险类别码

R11

危险品运输编码

UN 1230 3

危险类别

6.1(a)

包装等级

II

危险品标志

T; F

合成路线

共找到8条合成路线 >

盐酸古柯碱

盐酸古柯碱

苯甲醯艾克寧

苯甲醯艾克寧

上游原料

共找到29个上游原料 >

苯甲酸酐

脱水芽子碱盐酸盐

脱水芽子碱盐酸盐

(1R,5S)-8-azabicyclo[3.2.1]oct-2-ene-8-carboxylic acid tert-butyl ester

(1R,5S)-8-azabicyclo[3.2.1]oct-2-ene-8-carboxylic acid tert-butyl ester

tert-butyl (1R,2R,3S,5S)-2-carbamoyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate

tert-butyl (1R,2R,3S,5S)-2-carbamoyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate

(2R,5S)-N-(tert-butyloxycarbonyl)-5-[1'-(2'-methoxycarbonyl)ethyl]proline methyl ester

(2R,5S)-N-(tert-butyloxycarbonyl)-5-[1'-(2'-methoxycarbonyl)ethyl]proline methyl ester

下游产品

共找到6个下游商品 >

可卡乙碱

芽子碱

(1S,3S,4S,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid

(1S,3S,4S,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid

Benzoyl Ecgonine Isopropyl Ester

Benzoyl Ecgonine Isopropyl Ester

苯甲酸

琥珀酸

上游原料

水苯甲酸酐脱水芽子碱盐酸盐 (1R,5S)-8-azabicyclo[3.2.1]oct-2-ene-8-carboxylic acid tert-butyl ester tert-butyl (1R,2R,3S,5S)-2-carbamoyl-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate (2R,5S)-N-(tert-butyloxycarbonyl)-5-[1'-(2'-methoxycarbonyl)ethyl]proline methyl ester (3aS,4R,7S,8aS)-9-(tert-butoxycarbonyl)-3a,5,6,7,8,8a-hexahydro-4H-4,7-epiminocyclohepta[d]isoxazole-3-carboxylic acid (1R,2R,3S,5S)-2-cyano-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester tert-butyl (1R,2S,5S)-2-(phenylselanyl)-8-azabicyclo[3.2.1]octane-8-carboxylate (1R,2R,3S,5S)-tert-butyl 3-(benzoyloxy)-2-carbamoyl-8-azabicyclo[3.2.1]octane-8-carboxylate (1R,2R,3S,5S)-2-carbamoyl-8-azabicyclo[3.2.1]octan-3-yl benzoate (1R,2S,6S,8S)-5-Oxa-4,11-diaza-tricyclo[6.2.1.02,6]undec-3-ene-3,11-dicarboxylic acid 11-tert-butyl ester 3-ethyl ester (1R,5S)-8-甲基-8-氮杂双环[3.2.1]辛-2-烯古卡因 (1R,2R,5S)-2-Phenylselanyl-8-aza-bicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester RTI-128 芽子碱 (1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octan-2-one (1R,5S)-8-(tert-butyloxycarbonyl)-8-azabicyclo[3.2.1]-2-octanone (2R,5S)-N-benzyl-5-[1'-(2'-methoxycarbonyl)ethyl]proline methyl ester 盐酸古柯碱 3-((2S,5R)-5-(tert-butoxycarbonyl)pyrrolidin-2-yl)propanoic acid (1R,5S)-8-(tert-butyloxycarbonyl)-8-azabicyclo[3.2.1]-2-octanone p-tosylhydrazone (2R,5S)-5-[1'-(2'-methoxycarbonyl)ethyl]proline methyl ester (1R,2S,5S)-2-Phenylselanyl-8-aza-bicyclo[3.2.1]octane-8-carboxylic acid 1-chloro-ethyl ester 2-[(R)-1-Benzyl-5-tert-butoxycarbonyl-pyrrolidin-(2Z)-ylidene]-succinic acid dibenzyl ester 8-(tert-butyl) 3-methyl (1R,5S)-2-hydroxy-8-azabicyclo[3.2.1]oct-2-ene-3,8-dicarboxylate

下游产品

可卡乙碱芽子碱 (1S,3S,4S,5R)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid Benzoyl Ecgonine Isopropyl Ester 苯甲酸琥珀酸