4-n-pentylbenzene thiol | 4527-46-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯硫酚类
• 英文名称: 4-n-pentylbenzene thiol
• 英文别名: 4-n-pentylbenzenethiol；pentylthiophenol；p-n-pentylthiophenol；4-n-Pentylbenzolthiol；4-Pentyl-thiophenol；4-n-Amyl-thiophenol；4-Pentylbenzene-1-thiol；4-pentylbenzenethiol
• CAS: 4527-46-2
• 化学式: C₁₁H₁₆S
• 分子量: 180.314
• InChiKey: RMHIJJXBYFMPQP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  12
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  1
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2930909090

反应信息

• 作为反应物：
  描述：

  4-n-pentylbenzene thiol 、 七(6-溴-6-脱氧)-beta-环糊精 在 三乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以90%的产率得到Heptakis-[6-thio(4'-pentylphenyl)-6-deoxy]-β-cyclodextrin
  参考文献：
  名称：

  两亲性α-，β-和γ-环糊精的直接合成

  摘要：

  摘要描述了从全-（6-溴-6-脱氧）-α-，-β-和-γ-环糊精开始的两亲性α-，β-和γ-环糊精的干净的一步合成。亲脂性尾巴的作用是通过硫醚桥连接到位置C-6的各种芳基（苯基，对溴苯基，对氧丁氧基苯基，对戊基苯基以及邻，间和对硝基苯基）发挥的。每个吡喃葡萄糖单位。S-烷基化反应的产率非常高（85-95％）。

  DOI：

  10.1080/07328309608005692
• 作为产物：
  描述：

  4-N-戊(烷)基苯磺酰基氯 在 锌 作用下， 以 硫酸 、 水 为溶剂， 以71%的产率得到4-n-pentylbenzene thiol
  参考文献：
  名称：

  4-Substituted phenyl 4'-(5-N-alkyl-1,3-dioxan-2-yl) thiobenzoates

  摘要：

  本发明涉及一种公式为：##STR1##其中R.sub.1是具有1至10个碳原子的烷基基团，R.sub.2是具有1至10个碳原子的烷基或烷氧基，或氰基或硝基。本发明的化合物适用于电光显示器中的液晶材料。具体而言，这些化合物在加入到用于多路复用电光显示器的向列相液晶混合物中时，提供了宽广的向列相范围和高清除点。

  公开号：

  US04424372A1

文献信息

• [EN] 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS<br/>[FR] COMPOSES 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE POUR LE TRAITEMENT DE LA TUBERCULOSE
  申请人：OTSUKA PHARMA CO LTD

  公开号：WO2005042542A1

  公开（公告）日：2005-05-12

  The present invention provides a 2,3-dihydro-6-nitroimidazo[2,1-b]oxazole compound represented by the following general formula: (1)in the above formula (1), R1 represents a hydrogen atom or C1-C6 alkyl group, n represents an integer of 0 to 6, R1 and -(CH2)nR2 may form a spiro ring represented by the formula (30) below, together with the adjacent carbon atom (in the formula below, RRR represents a piperidyl group which may have substituents on the piperidine ring), (30)and R2 represents a benzothiazolyloxy group, quinolyloxy group, pyridyloxy group or the like. The present compound has an excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria.

  本发明提供了一种由以下一般式表示的2,3-二氢-6-硝基咪唑[2,1-b]噁唑化合物：(1)在上述式(1)中，R1代表氢原子或C1-C6烷基，n代表0至6的整数，R1和-(CH2)nR2可以与下面的式(30)一起形成一个螺环，与相邻的碳原子一起（在下面的式中，RRR代表可能在哌啶环上具有取代基的哌啶基），(30)和R2代表苯并噻唑氧基、喹啉氧基、吡啶氧基或类似物。该化合物对结核分枝杆菌、多药耐药结核分枝杆菌和非典型耐酸细菌具有出色的杀菌作用。
• NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF
  申请人：YAMAMOTO CHEMICALS, INC.

  公开号：US20210107924A1

  公开（公告）日：2021-04-15

  Provided are a novel naphthalocyanine compound, which has strong absorption in a near-infrared range, extremely weak absorption in a visible range, and high resistance such as light resistance and heat resistance, and exhibits excellent solubility in an organic solvent or a resin, a heat ray shielding material, and uses of the naphthalocyanine compound such as a heat ray shielding material and the like. The naphthalocyanine compound is represented by General Formula (1). wherein, in Formula (1), M represents two hydrogen atoms, a divalent metal, or a derivative of a trivalent or tetravalent metal, R 1 to R 3 each independently represent a hydrogen atom, a halogen atom, or a linear, branched, or cyclic alkyl group, A represents Formula (2), and B represents Formula (3), wherein, in Formula (2), R 4 to R 8 each independently represent a hydrogen atom, a halogen atom, an alkyl group, an alkoxy group, an alkylthio group, an aryloxy group, or an arylthio group, and wherein, in Formula (3), X represents an oxygen atom, a sulfur atom, and or an imino group, R 9 to R 13 each independently represent a hydrogen atom, a halogen atom, an alkyl group, an alkoxy group, an ester group, an amide group, or a sulfonamide group.

  提供了一种新型萘酞菁化合物，它在近红外范围内具有强烈的吸收能力，在可见光范围内具有极弱的吸收能力，并具有高耐光性和耐热性，并在有机溶剂或树脂中表现出优异的溶解性能，可用作热辐射屏蔽材料，以及该萘酞菁化合物的用途，例如热辐射屏蔽材料等。该萘酞菁化合物由通式（1）表示。在式（1）中，M代表两个氢原子、二价金属或三价或四价金属的衍生物，R1至R3各自独立地表示氢原子、卤素原子或线性、支链或环烷基，A代表式（2），B代表式（3），在式（2）中，R4至R8各自独立地表示氢原子、卤素原子、烷基、烷氧基、烷硫基、芳氧基或芳硫基，在式（3）中，X表示氧原子、硫原子或亚胺基，R9至R13各自独立地表示氢原子、卤素原子、烷基、烷氧基、酯基、酰胺基或磺酰胺基。
• 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis
  申请人：Tsubouchi Hidetsugu

  公开号：US20080119478A1

  公开（公告）日：2008-05-22

  The present invention provides a 2,3-dihydro-6-nitroimidazo[2,1-b]oxazole compound represented by the following general formula: (1) in the above formula (1), R1 represents a hydrogen atom or C1-C6 alkyl group, n represents an integer of 0 to 6, R1 and —(CH2) n R2 may form a spiro ring represented by the formula (30) below, together with the adjacent carbon atom (in the formula below, RRR represents a piperidyl group which may have substituents on the piperidine ring), (30) and R2 represents a benzothiazolyloxy group, quinolyloxy group, pyridyloxy group or the like. The present compound has an excellent bactericidal action against Mycobacterium tuberculosis , multi-drug-resistant Mycobacterium tuberculosis , and atypical acid-fast bacteria.

  本发明提供了一种由下述通式（1）表示的2,3-二氢-6-硝基咪唑[2,1-b]噁唑化合物： 在上述式（1）中，R1代表氢原子或C1-C6烷基，n代表0到6的整数，R1和—(CH2)nR2可以与相邻的碳原子形成如下式（30）所示的螺环，其中，在下式中，RRR代表可能在哌啶环上具有取代基的哌啶基： （30）且R2代表苯并噻唑氧基、喹啉氧基、吡啶氧基或类似基团。该化合物对结核分枝杆菌、多重耐药结核分枝杆菌和非典型酸杆菌具有优异的杀菌作用。
• 2-Aminophenol derivatives
  申请人：ONO PHARMACEUTICAL CO., LTD.

  公开号：EP0081321A1

  公开（公告）日：1983-06-15

  2-AMINOPHENOL derivatives of the general formula: [wherein Z represents a straight alkylene or alkenylene group containing from 1 to 6 carbon atom(s), R1 represents a hydrogen atom, a halogen atom, a straight or branched chain alkyl group containing from 1 to 6 carbon atom(s), a straight or branched chain alkoxy group containing from 1 to 4 carbon atom(s) or a group represented by general formula: (wherein R4 represents a hydrogen atom or a straight or branched chain alkyl group containing from 1 to 6 carbon atom(s).), R2 represents a hydrogen atom, a straight or branched chain alkyl group containing from 1 to 4 carbon atom(s) or a group represented by a formula: R' is attached to the 6th or 4th position of the benzene ring: when R' is attached to the 6th position of the benzene ring, Z-COOR2 is attached to the 4th position of the benzene ring, and when R' is attached to the 4th position of the benzene ring, Z-COOR2 is attached to the 6th position of the benzene ring.] and pharmaceutically acceptable acid addition salts thereof, possess a strong inhibitory effect on 5-lipoxygenase specifically, or 5-lipoxygenase and cyclooxygenase at the same time, and therefore, are useful as treating and preventing agents for diseases which induced by leukotrienes, e.g. allergic tracheal and bronchial diseases or allergic lung diseases, allergic shocks or various allergic inflammations, and various inflammations induced by prostaglandins.

  通式如下的 2-氨基苯酚衍生物： [其中 Z 代表含 1 至 6 个碳原子的直链亚烷基或烯基，R1 代表氢原子、卤素原子、含 1 至 6 个碳原子的直链或支链烷基、含 1 至 4 个碳原子的直链或支链烷氧基或通式如下的基团： (其中 R4 代表氢原子或含有 1 至 6 个碳原子的直链或支链烷基），R2 代表氢原子、含有 1 至 4 个碳原子的直链或支链烷基或由通式表示的基团： R'连接到苯环的第6位或第4位：当R'连接到苯环的第6位时，Z-COOR2连接到苯环的第4位；当R'连接到苯环的第4位时，Z-COOR2连接到苯环的第6位]。 本品及其药学上可接受的酸加成盐对特异性 5-脂氧合酶或同时对 5-脂氧合酶和环氧合酶有很强的抑制作用，因此可作为治疗和预防由白三烯诱发的疾病的药物，如过敏性气管和支气管疾病或过敏性肺部疾病、过敏性休克或各种过敏性炎症以及由前列腺素诱发的各种炎症。
• PYRIMIDINE DERIVATIVE, PRODUCTION THEREOF, AND ANDROGEN INHIBITOR
  申请人：OTSUKA PHARMACEUTICAL CO., LTD.

  公开号：EP0503099A1

  公开（公告）日：1992-09-16

  A pyrimidine derivative represented by general formula (I), a pharmaceutically acceptable salt thereof, and an androgen inhibitor comprising the same having an excellent effect of treating prostatic hyperplasia, female hypertrichosis, and male baldness or pimple: wherein R¹ represents hydrogen or hydroxyl; R² represents hydrogen, lower alkoxycarbonyl, lower alkoxy, halogen, lower alkyl, C₃ to C₈ cycloalkyl, lower alkoxycarbonyl lower alkyl, carboxyl, carboxylated lower alkyl, CONHR, cyano, phenyl, phenylated lower alkyl, lower alkanoyloxy lower alkyl, benzoyl, lower alkanoyl or hydroxylated lower alkyl; R³ represents hydrogen, hydroxy, lower alkyl, C₃ to C₈ cycloalkyl, halogenated lower alkyl or phenyl; R⁴ represents hydrogen, lower alkyl or lower alkoxy, R⁵ represents hydrogen, lower alkyl, lower alkoxy lower alkyl or halogenated lower alkyl.

  一种由通式(I)代表的嘧啶衍生物、其药学上可接受的盐，以及由其组成的雄激素抑制剂，具有治疗前列腺增生、女性多毛症、男性秃头或丘疹的良好效果：其中，R¹代表氢或羟基；R²代表氢、低级烷氧基羰基、低级烷氧基、卤素、低级烷基、C₃至C₈环烷基、低级烷氧基羰基低级烷基、羧基、羧化低级烷基、CONHR、氰基、苯基、苯基化低级烷基、低级烷酰氧基低级烷基、苯甲酰基、低级烷酰基或羟化低级烷基；R³ 代表氢、羟基、低级烷基、C₃至 C₈ 环烷基、卤代低级烷基或苯基；R⁴ 代表氢、低级烷基或低级烷氧基，R⁵ 代表氢、低级烷基、低级烷氧基低级烷基或卤代低级烷基。