3-(2-dimethylaminomethyl-1-hydroxy-cyclohexyl)-phenyl 2-hydroxybenzoate | 269079-72-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 缩酚酸和缩酚酸环醚类
• 英文名称: 3-(2-dimethylaminomethyl-1-hydroxy-cyclohexyl)-phenyl 2-hydroxybenzoate
• 英文别名: 3-{2-[(Dimethylamino)methyl]-1-hydroxycyclohexyl}phenyl 2-hydroxybenzoate；[3-[2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenyl] 2-hydroxybenzoate
• CAS: 269079-72-3
• 化学式: C₂₂H₂₇NO₄
• 分子量: 369.461
• InChiKey: OLXCPJRIWXIFTH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  27
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  70
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• Novel esters derived from (rr,ss)-2-hydroxybenzoate of 3-(2-dimethylaminomethyl-1-hydroxycyclohexyl)phenyl
  申请人：——

  公开号：US20030100598A1

  公开（公告）日：2003-05-29

  New esters derived from substituted phenyl-cyclohexyl compounds, which are derived from Tramadol, process for obtaining them and their use for preparing a drug with analgesic properties. These new compounds of general formula (I) have a higher analgesic activity, a lower toxicity and a longer effective time period than Tramadol.

  新的酯类化合物来源于取自曲马多（Tramadol）的取代苯基-环己基化合物，其制备方法以及它们用于制备具有镇痛性质的药物。这些新化合物的通式（I）具有比曲马多更高的镇痛活性，更低的毒性和更长的有效时间。
• NOVEL ESTERS DERIVED FROM (RR,SS)-2-HYDROXYBENZOATE OF 3-(2-DIMETHYLAMINOMETHYL-1-HYDROXYCYCLOHEXYL)PHENYL
  申请人：VITA-INVEST, S.A.

  公开号：EP1251120A1

  公开（公告）日：2002-10-23

  New esters derived from (RR,SS)-3-(2-dimethylaminomethyl-1-hydroxycyclohexyl)phenyl 2-hydroxybenzoate, analog to Tramadol, a process for obtaining them and the use of these compounds for the production of a medicament with analgesic properties. These new products of general formula (I) exhibit an analgesic activity higher than that of tramadol.

  由(RR,SS)-3-(2-二甲基氨基甲基-1-羟基环己基)苯基 2-羟基苯甲酸酯（曲马多的类似物）衍生出的新酯、获得它们的工艺以及利用这些化合物生产具有镇痛特性的药物。 这些通式（I）新产品的镇痛活性高于曲马多。
• [DE] MULTICYCLISCHE VERBINDUNGEN IN DRUCKEMPFINDLICHEN KLEBSTOFFEN<br/>[EN] MULTI-CYCLIC COMPOUNDS IN PRESSURE-SENSITIVE ADHESIVES<br/>[FR] COMPOSES MULTICYCLIQUES DANS DES ADHESIFS SENSIBLES A LA PRESSION
  申请人：GRUENENTHAL GMBH

  公开号：WO2007059894A2

  公开（公告）日：2007-05-31

  (DE) Die Erfindung betrifft einen druckempfindlichen Klebstoff enthaltend wenigstens einen multicyclischen, gesättigten oder ungesättigten Kohlenwasserstoff, der substituiert ist mit mindestens einer funktionellen Gruppe ausgewählt aus der Gruppe bestehend aus -(CH2)POH, -(CH2)POC1-6-AIkyl, -(CH2)POCO-C1-6-Alkyl, -(CH2)PSH, -(CH2)PCN, -(CH2)PN3, -(CH2)PNH2, -(CH2)PNHC1-6-Alkyl, -(CH2)PN(C1-6-Alkyl)2,-(CH2)PNHCO-C1-6-Alkyl, -(CH2)PCHO, -(CH2)PCOC1-6-Alkyl, -(CH2)PCO2H,-(CH2)PCO2C1-6-Alkyl, -(CH2)PCONHC1-6-Alkyl und -(CH2)PCON(C1-6-Alkyl)2, wobei p jeweils gleich oder verschieden 0, 1 , 2, 3, 4, 5 oder 6 sein kann. Der Klebstoff eignet sich insbesondere zur Befestigung von Gegenständen auf der Haut, wie für Pflaster und Transdermale Therapeutische Systeme.(EN) The invention relates to a pressure-sensitive adhesive containing at least one type of multi-cyclic saturated or unsaturated hydrocarbon, which is substituted by at least one functional group selected from a group consisting of -(CH2)POH, -(CH2)POC1-6-AIkyl, -(CH2)POCO-C1-6-Alkyl, -(CH2)PSH, -(CH2)PCN, -(CH2)PN3, -(CH2)PNH2, -(CH2)PNHC1-6-Alkyl, -(CH2)PN(C1-6-Alkyl)2,-(CH2)PNHCO-C1-6-Alkyl, -(CH2)PCHO, -(CH2)PCOC1-6-Alkyl, -(CH2)PCO2H,-(CH2)PCO2C1-6-Alkyl, -(CH2)PCONHC1-6-Alkyl and -(CH2)PCON(C1-6-Alkyl)2, wherein p can be identical to or different from 0, 1, 2, 3, 4, 5 or 6. The inventive adhesive is particularly suitable for fastening objects such as plasters and transdermal therapeutic systems to the skin.(FR) L'invention concerne un adhésif sensible à la pression contenant au moins un hydrocarbure multicyclique saturé ou non saturé, qui est substitué par au moins un groupe fonctionnel sélectionné dans le groupe comprenant: -(CH2)POH, -(CH2)PO-alkyle C1-6, -(CH2)POCO-alkyle C1-6, -(CH2)PSH, -(CH2)PCN, -(CH2)PN3, -(CH2)PNH2, -(CH2)PNH-alkyle C1-6, -(CH2)PN(alkyle C1-6)2,-(CH2)PNHCO-alkyle C1-6, -(CH2)PCHO, -(CH2)PCO-alkyle C1-6, -(CH2)PCO2H,-(CH2)PCO2-alkyle C1-6, -(CH2)PCONH-alkyle C1-6 et -(CH2)PCON(alkyle C1-6)2, p, dans chaque cas identique ou différent, pouvant valoir 1, 2, 3, 4, 5 ou 6,. Ledit adhésif se prête particulièrement à la fixation d'articles sur la peau, tels que des emplâtres et des systèmes thérapeutiques transdermiques.

  该发明涉及一种压力敏感的胶水，包含至少一种多环饱和或不饱和的碳氢化合物，其被至少一种从以下官能团中选取的功能基团取代：-(CH2)POH、-( )POC1-6-AIkyl、-( )POCO-C1-6-Alkyl、-( )PSH、-( )PCN、-( )PN3、-( )PNH2、-( )PNHC1-6-Alkyl、-( )PN(C1-6-Alkyl)2、-( )PNHCO-C1-6-Alkyl、-( )PCHO、-( )PCOC1-6-Alkyl、-( )PCO2H、-( )PCO2C1-6-Alkyl、-( )PCONHC1-6-Alkyl和-( )PCON(C1-6-Alkyl)2，其中p可以在每个情况下各自相同或不同地等于0、1、2、3、4、5或6。该胶水特别适合用于胶着于皮肤上的对象，例如绷带和治疗皮层系统的医疗系统。
• NEW ESTERS DERIVED FROM SUBSTITUTED PHENYL-CYCLOHEXYL COMPOUNDS
  申请人：LABORATORIOS VITA, S.A.

  公开号：EP1127871B1

  公开（公告）日：2003-09-10
• ESTERS DERIVED FROM (RR,SS)-2-HYDROXYBENZOATE OF 3-(2-DIMETHYLAMINOMETHYL-1-HYDROXYCYCLOHEXYL)PHENYL
  申请人：LABORATORIOS VITA, S.A.

  公开号：EP1251120B1

  公开（公告）日：2004-12-08