Essigsaeure-<2-(2-methyl-benzthiazol-6-yl)-ethylester> | 1439-75-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻唑类
• 英文名称: Essigsaeure-<2-(2-methyl-benzthiazol-6-yl)-ethylester>
• 英文别名: 1-acetoxy-2-(2-methyl-benzothiazol-6-yl)-ethane；2-Methyl-6-acetoxyethylbenzothiazole；2-(2-methyl-1,3-benzothiazol-6-yl)ethyl acetate
• CAS: 1439-75-4
• 化学式: C₁₂H₁₃NO₂S
• 分子量: 235.307
• InChiKey: VKSDULKNLNUODR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  67.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  <2-Methyl-benzthiazol-6-yl>-essigsaeureaethylester 在 lithium aluminium tetrahydride 作用下， 以 乙醚 为溶剂， 反应 5.0h， 生成 Essigsaeure-<2-(2-methyl-benzthiazol-6-yl)-ethylester>
  参考文献：
  名称：

  Zubarovskii,V.M.; Bachurina,M.P., Journal of general chemistry of the USSR, 1964, vol. 34, p. 3848 - 3851

  摘要：

  DOI：

文献信息

• Fluorescent dibenzazole derivatives and methods related thereto
  申请人：Promega Biosciences, Inc.

  公开号：US06140051A1

  公开（公告）日：2000-10-31

  Dibenzazole compounds having the general structure: ##STR1## wherein; R.sub.1, R.sub.2, R.sub.3, R.sub.4, R.sub.5, R.sub.6 are independently H or a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety; Y is H or a cleavable moiety; X is a hydrogen, halogen, CF.sub.3, or SO.sub.3 H; V and W are oxygen or sulfur; Z is --C.dbd.C--, --C.tbd.C-- or an aromatic ring moiety; and n is 0, 1, or 2. When n=0 at least one of R.sub.1, R.sub.2, R.sub.3, R.sub.4, and R.sub.5 is a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety or X is a halogen, CF.sub.3 or SO.sub.3 H. These compounds are highly fluorescent and can be easily detected using a fluorometer. Derivatives in which the Y group is a substituent other than H contain a fluorescence inhibiting chemical moiety that upon removal restores the fluorescence of the compound. Methods for their synthesis and application are provided.

  具有以下一般结构的二苯咪唑化合物：##STR1## 其中，R.sub.1，R.sub.2，R.sub.3，R.sub.4，R.sub.5，R.sub.6独立地为H或有助于化合物溶解性的取代基，或为连接化合物到另一分子的连接臂提供取代基；Y为H或可断裂的分子基；X为氢，卤素，CF.sub.3或SO.sub.3 H；V和W为氧或硫；Z为--C.dbd.C--，--C.tbd.C--或芳香环分子；n为0、1或2。当n=0时，R.sub.1，R.sub.2，R.sub.3，R.sub.4和R.sub.5中至少一个为有助于化合物溶解性的取代基，或为连接化合物到另一分子的连接臂提供取代基，或X为卤素，CF.sub.3或SO.sub.3 H。这些化合物高度荧光，可以使用荧光计轻松检测。其中Y基为除H以外的取代基的衍生物含有一种荧光抑制化学基团，去除后可以恢复化合物的荧光。提供了其合成和应用的方法。
• FLUORESCENT DIBENZAZOLE DERIVATIVES AND METHODS RELATED THERETO
  申请人：Promega Biosciences, Inc.

  公开号：EP1000042A1

  公开（公告）日：2000-05-17
• US6140051A
  申请人：——

  公开号：US6140051A

  公开（公告）日：2000-10-31
• [EN] FLUORESCENT DIBENZAZOLE DERIVATIVES AND METHODS RELATED THERETO<br/>[FR] DERIVES DE DIBENZAZOLE FLUORESCENTS ET METHODES ASSOCIEES
  申请人：PROMEGA BIOSCIENCES, INC.

  公开号：WO1999003849A1

  公开（公告）日：1999-01-28

  (EN) Dibenzazole compounds having general structure (I) and (II), wherein R1, R2, R3, R4, R5, R6 are independently H or a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety; Y is H or a cleavalable moiety; X is a hydrogen, halogen, CF3, or SO3H; V and W are oxygen or sulfur; Z is -C=C-, -C$m(Z)C- or an aromatic ring moiety; and n is 0, 1, or 2. When n=0 at least one of R1, R2, R3, R4, and R5 is a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety or X is a halogen, CF3 or SO3H. These compounds are highly fluorescent and can be easily detected using a fluorometer. Derivatives in which the Y group is a substituent other than H contain a fluorescence inhibiting chemical moiety that upon removal restores the fluorescence of the compound. Methods for their synthesis and application are provided.(FR) L'invention concerne des composés de dibenzazole de structure générale (I) et (II), dans lesquelles; R1; R2, R3, R4, R5, R6 sont indépendamment H ou un substituant qui contribue à la solubilité du composé ou qui constitue un bras de liaison permettant de lier le composé à une autre fraction; Y est H ou une fraction clivable; X est hydrogène, halogène, CF3, ou SO3H; V et W sont oxygène ou soufre; Z est -C=C-, -C$m(Z)C- ou une fraction à noyau aromatique; et n est égal à 0, 1 ou 2. Lorsque n=0, l'un au moins de R1; R2, R3, R4, et R5 est un substituant qui contribue à la solubilité du composé ou qui constitue un bras de liaison permettant de lier le composé à une autre fraction ou Y est halogène, CF3, ou SO3H. Ces composés sont très fluorescents et peuvent être facilement détectés à l'aide d'un fluoromètre. L'invention concerne également des dérivés, dans lesquels le groupe Y est un substituant autre que H, renfermant une fraction chimique inhibant la fluorescence, qui une fois éliminée, redonne au composé sa fluorescence. L'invention concerne enfin des méthodes de synthèse et d'application de ces composés.
• [EN] FLUORESCENT DIBENZAZOLE DERIVATIVES AND METHODS RELATED THERETO<br/>[FR] DERIVES DE DIBENZAZOLE FLUORESCENTS ET PROCEDES CONCERNANT CES DERIVES
  申请人：PROMEGA BIOSCIENCES INC

  公开号：WO2000004007A1

  公开（公告）日：2000-01-27

  Dibenzazole compounds having general structure (I and II), wherein: R1, R2, R3, R4, R5, R6 are independently H or a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety; Y is H or a cleavable moiety; X is a hydrogen, halogen, CF3, or SO3H; V and W are oxygen or sulfur; Z is -C=C-, -C C- or an aromatic ring moiety; and n is 0, 1, or 2. When n=0 at least one of R1, R2, R3, R4, and R5 is a substituent which aids in solubility of the compound or which provides a linker arm for linking the compound to another moiety or X is a halogen, CF3 or SO3H. These compounds are highly fluorescent and can be easily detected using a fluorometer. Derivatives in which the Y group is a substituent other than H contain a fluorescence inhibiting chemical moiety that upon removal restores the fluorescence of the compound. Methods for their synthesis and application are provided.