CAS: 6829-98-7; 3-(5,6-Dihydrobenzo[b][1]Benzazepin-11-yl)-N,N-Dimethylpropan-1-Amine Oxide

该化合物是一种化学化合物,来自三环抗抑郁物,一种三环抗抑郁物,其特征是存在一个N-氧化功能组,该功能组由同聚物结构中的氮原子氧化形成,这种改变可影响该化合物的药理特性及其与生物系统的相互作用.Imipromeine N-Ox通常为白色至白色的固体,在极地溶剂中可溶解.其分子结构包括二苯环戊基,在三环抗抑郁剂中很常见,而N-氧化组可影响其与...

英文名称3-(5,6-Dihydrobenzo[b][1]Benzazepin-11-yl)-N,N-Dimethylpropan-1-Amine Oxide
中文名称氧丙咪嗪
IUPAC名称5H-Dibenz(b,f)azepine-5-propanamine, 10,11-dihydro-N,N-dimethyl-, N-oxide
其它别名5H-Dibenz[b,f]azepine,5-[3-(dimethylamino)propyl]-10,11-dihydro-, N-oxide (7CI,8CI); 5-[3-(Dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine5-oxide; Imipramine N-oxide; Imipraminoxide
CAS编号6829-98-7
MFCD编号:MFCD00865458
FDA UNII编号:8MKS280XJW
分子式:C19H24N2O分子量:296.41
产品CID: 1672562
产品分类有机原料 → 有机杂环化合物 → 苯氮卓类

相似结构搜索
InChIKey: QZIQORUGXBPDSU-UHFFFAOYSA-N
1S/C19H24N2O/c1-21(2,22)15-7-14-20-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20/h3-6,8-11H,7,12-15H2,1-2H3
计算化学: 氢键受体数2.0氢键供体数0.0可旋转键数4.0

物理性质

熔点93-95 °C
pKa:4.71±0.40(预测)
PSA:32.67
LogP:3.9735
溶解性Chloroform (Slightly), Methanol (Slightly)
外观形态白色至类白色白色至类白色固体
储存条件-20°C 冷藏

上下游产品

CAS号50-49-7 米帕明 | CAS号113-52-0 丙咪嗪盐酸盐 | CAS号50-49-7 米帕明

合成工艺路线路线简述

合成目标产物 Imipramine N-Oxide 主要起始原料 Imipramine Hydrochloride
(文献来源)合成步骤主要原料 Imipramine Hydrochloride

📜米帕明置于双氧水体系中,用甲醇作为反应溶剂,化学反应 168.0H,反应生成氧丙咪嗪
参考文献:A Chemoselective Deoxygenation Of N-Oxides By Sodium Borohydride-raney Nickel In Water
标题:A Chemoselective Deoxygenation Of N-Oxides By Sodium Borohydride-raney Nickel In Water
摘要:A Simple And Convenient Protocol For Deoxygenation Of Aliphatic And Aromatic N-Oxides To The Corresponding Amines In Good To Excellent Yield Using Sodium Borohydride-Raney Nickel In Water Is Reported. Other Functional Moieties Such As Alkenes,Halides,Ethers,And Amides Are Unaffected Under The Present Reaction Condition. (C) 2010 Elsevier Ltd. All Rights Reserved.
DOI:10.1016/j.Tetlet.2010.08.045

海关参考信息

2902600000-乙苯
2921440000-二苯胺
💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:US-2008214827-A1
优先权日:2004-02-03
标题:Synthesis of Cyanoimino-Benzoimidazoles
发明人：GOEHRING R RICHARD; WHITEHEAD JOHN; SHAO BIN
权利人:EURO CELTIQUE SA
摘要:Disclosed in certain embodiments is a process for synthesizing a compound of formula (V) and salts thereof.

专利号:CA-2555219-A1
优先权日:2004-02-03
标题 :Synthesis of cyanoimino-benzoimidazoles

专利号:WO-2005075459-A1
优先权日:2004-02-03
标题:Synthesis of cyanoimino-benzoimidazoles

专利号:JP-2007520493-A
优先权日:2004-02-03
标题 :Synthesis of cyanoiminobenzimidazole

专利号:EP-1711484-A4
优先权日:2004-02-03
标题:SYNTHESIS OF CYANOIMINO-BENZOIMIDAZOLES

专利号:EP-1711484-A1
优先权日:2004-02-03
标题:Synthesis of cyanoimino-benzoimidazoles