(2-氨基-2-甲基丙基)苯甲酸酯 | 3539-92-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: (2-氨基-2-甲基丙基)苯甲酸酯
• 英文名称: 2-amino-1-benzoyloxy-2-methyl-propane; hydrochloride
• 英文别名: 2-Amino-1-benzoyloxy-2-methyl-propan; Hydrochlorid；2-amino-2-methyl-1-propyl benzoate hydrochloride；(2-amino-2-methylpropyl) benzoate;hydrochloride
• CAS: 3539-92-2
• 化学式: C₁₁H₁₅NO₂*ClH
• 分子量: 229.707
• InChiKey: NWTLOVSZEMDODV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.13
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  53.9
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (2-氨基-2-甲基丙基)苯甲酸酯 在 ammonium hydroxide 作用下， 生成 N-(2-hydroxyl-1,1-dimethylethyl) benzamide
  参考文献：
  名称：

  Julia,S.; Papantoniou,C., Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1965, vol. 260, p. 1440 - 1441

  摘要：

  DOI：
• 作为产物：
  描述：

  苯甲酸 在 盐酸 、 乙醇 、 氯仿 作用下， 生成 (2-氨基-2-甲基丙基)苯甲酸酯
  参考文献：
  名称：

  Reactions of Ethylenimines. VII. Hammett p Constants for Ring Opening with Benzoic Acids

  摘要：

  DOI：

  10.1021/ja01586a010

文献信息

• Certain chloroamino esters of pyridine carboxylates and derivatives
  申请人：INTERx Research Corporation

  公开号：US04036843A1

  公开（公告）日：1977-07-19

  There is provided, a novel class of compounds exhibiting antibacterial activity and having the formula: ##STR1## wherein X and Y each represent a member which may be the same or different selected from the group consisting of H and Cl with the proviso that X and Y cannot represent H simultaneously; R.sub.1 and R.sub.2 each represent a member which may be the same or different selected from the group consisting of an n- or branched alkyl group of from 1 to 20 carbon atoms, an aryl group (phenyl, naphthyl, etc.) and a ##STR2## GROUP, WHEREIN M REPRESENTS AN INTEGER OF FROM 2 TO 5; N REPRESENTS AN INTEGER OF 1 TO 8; AND Z represents a member selected from the group consisting of an --OOCR.sub.3 group, an --OR.sub.3 group and an --OCH.sub.2 OR.sub.3 group, wherein R.sub.3 represents a member selected from the group consisting of an n- or branched alkyl group of 1 to 20 carbon atoms, a phenyl group, a naphthyl group, a benzyl group, ##STR3## WHEREIN X is a halogen atom (Cl, Br, I), ##STR4## WHEREIN R.sub.4 represents a member selected from the group consisting of H, an n- or branched alkyl group, a benzyl group, and a --(CH.sub.2).sub.p COOH group, wherein p represents an integer of 1 to 4, and wherein W.sup.- represents a non-toxic pharmaceutically acceptable inorganic or organic anion.

  提供了一类新型化合物，具有抗菌活性，其化学式为：##STR1## 其中X和Y分别表示从H和Cl组成的群中选择的可以相同或不同的成员，但X和Y不能同时表示H; R.sub.1和R.sub.2分别表示从1到20个碳原子的n-或支链烷基，芳基（苯基，萘基等）和##STR2## GROUP，其中M表示2到5的整数；N表示1到8的整数；Z表示从--OOCR.sub.3群，--OR.sub.3群和--OCH.sub.2 OR.sub.3群中选择的成员，其中R.sub.3表示从1到20个碳原子的n-或支链烷基，苯基，萘基，苄基，##STR3## 其中X是卤素原子（Cl，Br，I），##STR4## 其中R.sub.4表示从H，n-或支链烷基，苄基和--(CH.sub.2).sub.p COOH群中选择的成员，其中p表示1到4的整数，并且W.sup.-表示非毒性药物可接受的无机或有机阴离子。
• Antibacterially active N-chloroamino ester derivatives of alkyl
  申请人：INTERx Research Corporation

  公开号：US04171452A1

  公开（公告）日：1979-10-16

  There is provided, a novel class of compounds exhibiting antibacterial activity and having the formula: ##STR1## wherein X and Y each represent a member which may be the same or different selected from the group consisting of H and Cl with the proviso that X and Y cannot represent H simultaneously; R.sub.1 and R.sub.2 each represent a member which may be the same or different selected from the group consisting of an n- or branched alkyl group of from 1 to 20 carbon atoms, an aryl group (phenyl, naphthyl, etc.) and ##STR2## WHEREIN M REPRESENTS AN INTEGER OF FROM 2 TO 5; N REPRESENTS AN INTEGER OF 1 TO 8; AND Z represents a member selected from the group consisting of an --OOCR.sub.3 group, an --OR.sub.3 group and an --OCH.sub.2 OR.sub.3 group, Wherein R.sub.3 represents a member selected from the group consisting of an n- or branched alkyl group of 1 to 20 carbon atoms, a phenyl group, a naphthyl group, a benzyl group, ##STR3## WHEREIN X is a halogen atom (Cl, Br, I), ##STR4## WHEREIN R.sub.4 represents a member selected from the group consisting of H, an n- or branched alkyl group, a benzyl group, an O atom, and a --(CH.sub.2).sub.p COOH group, wherein p represents an integer of 1 to 4, and wherein W.sup..theta. represents a non-toxic pharmaceutically acceptable inorganic or organic anion.

  提供了一类新型化合物，具有抗菌活性，其化学式为：##STR1## 其中X和Y分别表示可以相同或不同的成员，选自H和Cl的群组，但是X和Y不能同时表示H; R.sub.1 和R.sub.2分别表示可以相同或不同的成员，选自1到20个碳原子的n-或支链烷基，苯基，萘基等以及##STR2## 其中M表示2到5的整数; N表示1到8的整数; Z表示选自--OOCR.sub.3基团，--OR.sub.3基团和--OCH.sub.2 OR.sub.3基团的成员，其中R.sub.3表示选自1到20个碳原子的n-或支链烷基，苯基，萘基，苄基，##STR3## 其中X是卤素原子(Cl，Br，I)，##STR4## 其中R.sub.4表示选自H，n-或支链烷基，苄基，O原子和--(CH.sub.2).sub.p COOH基团的成员，其中p表示1到4的整数，W.sup..theta.表示非毒性药用可接受的无机或有机阴离子。
• Novel soft N-chloroamino alcohol derivatives exhibiting antibacterial
  申请人：INTERx Research Corporation

  公开号：US04092420A1

  公开（公告）日：1978-05-30

  There is provided, a novel class of compounds exhibiting antibacterial activity and having the formula: ##STR1## wherein X and Y each represent a member which may be the same or different selected from the group consisting of H and Cl with the proviso that X and Y cannot represent H simultaneously; R.sub.1 and R.sub.2 each represent a member which may be the same or different selected from the group consisting of an n- or branched alkyl group of from 1 to 20 carbon atoms, an aryl group (phenyl, naphthyl, etc.) and a ##STR2## WHEREIN M REPRESENTS AN INTEGER OF FROM 2 TO 5; N REPRESENTS AN INTEGER OF 1 TO 8; AND Z represents a member selected from the group consisting of an --OOCR.sub.3 group, an --OR.sub.3 group and an --OCH.sub.2 OR.sub.3 group, wherein R.sub.3 represents a member selected from the group consisting of an n- or branched alkyl group of 1 to 20 carbon atoms, a phenyl group, a naphthyl group, a benzyl group, ##STR3## WHEREIN X is a halogen atom (Cl, Br, I), ##STR4## WHEREIN R.sub.4 represents a member selected from the group consisting of H, an n- or branched alkyl group, a benzyl group, and a --(CH.sub.2).sub.p COOH group, wherein p represents an integer of 1 to 4, and wherein W.sup..theta. represents a non-toxic pharmaceutically acceptable inorganic or organic anion.

  提供了一种新型化合物，具有抗菌活性，其化学式为：##STR1## 其中X和Y各代表H和Cl中的一种，可以相同或不同，但X和Y不能同时代表H；R.sub.1和R.sub.2各代表1至20个碳原子的n-或支链烷基、芳基（苯基、萘基等）和##STR2## 其中M代表2至5的整数；N代表1至8的整数；Z代表选择自--OOCR.sub.3基团、--OR.sub.3基团和--OCH.sub.2 OR.sub.3基团的一种基团，其中R.sub.3代表选择自1至20个碳原子的n-或支链烷基、苯基、萘基、苄基、##STR3## 其中X是卤素原子(Cl、Br、I)、##STR4## 其中R.sub.4代表选择自H、n-或支链烷基、苄基和--(CH.sub.2).sub.p COOH基团的一种基团，其中p代表1至4的整数，且W.sup..theta.代表非毒性药学上可接受的无机或有机阴离子。
• Antibacterial novel soft n-chloroamino alcohol derivatives
  申请人：INTERx Research Corporation

  公开号：US04115588A1

  公开（公告）日：1978-09-19

  There is provided, a novel class of compounds exhibiting antibacterial activity and having the formula: ##STR1## wherein X and Y each represent a member which may be the same or different selected from the group consisting of H and Cl with the proviso that X and Y cannot represent H simultaneously; R.sub.1 and R.sub.2 each represent a member which may be the same or different selected from the group consisting of an n- or branched alkyl group of from 1 to 20 carbon atoms, an aryl group (phenyl, naphthyl, etc.) and ##STR2## WHEREIN M REPRESENTS AN INTEGER OF FROM 2 TO 5; N REPRESENTS AN INTEGER OF 1 TO 8; AND Z represents a member selected from the group consisting of an --OOCR.sub.3 group, an --OR.sub.3 group and an --OCH.sub.2 OR.sub.3 group, wherein R.sub.3 represents a member selected from the group consisting of an n- or branched alkyl group of 1 to 20 carbon atoms, a phenyl group, a naphthyl group, a benzyl group, ##STR3## WHEREIN X is a halogen atom (Cl, Br, I), ##STR4## WHEREIN R.sub.4 represents a member selected from the group consisting of H, an n- or branched alkyl group, a benzyl group, and a --(CH.sub.2).sub.p COOH group, wherein p represents an integer of 1 to 4, and wherein W.sup..crclbar. represents a non-toxic pharmaceutically acceptable inorganic or organic anion.

  提供了一类新型化合物，具有抗菌活性，其化学式为：##STR1## 其中X和Y各代表从H和Cl组成的群体中选择的可相同可不同的成员，但X和Y不能同时代表H；R.sub.1和R.sub.2各代表从1到20个碳原子的n-或支链烷基、芳基（苯基、萘基等）和##STR2## 其中M表示2到5的整数；N表示1到8的整数；Z代表从--OOCR.sub.3群体、--OR.sub.3群体和--OCH.sub.2 OR.sub.3群体中选择的成员，其中R.sub.3代表从1到20个碳原子的n-或支链烷基、苯基、萘基、苄基、##STR3## 其中X是卤素原子(Cl、Br、I)，##STR4## 其中R.sub.4代表从H、n-或支链烷基、苄基和--(CH.sub.2).sub.p COOH群体中选择的成员，其中p表示1到4的整数，W.sup..crclbar.代表一种非毒性的药物可接受的无机或有机阴离子。
• US2463831
  申请人：——

  公开号：——

  公开（公告）日：——