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2,3-dimethylcyclopentanol | 2702-13-8

中文名称
——
中文别名
——
英文名称
2,3-dimethylcyclopentanol
英文别名
2,3-Dimethylcyclopentan-1-ol
2,3-dimethylcyclopentanol化学式
CAS
2702-13-8
化学式
C7H14O
mdl
——
分子量
114.188
InChiKey
SILZXJUHRUTSCO-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    1.7
  • 重原子数:
    8
  • 可旋转键数:
    0
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    20.2
  • 氢给体数:
    1
  • 氢受体数:
    1

反应信息

  • 作为反应物:
    参考文献:
    名称:
    Oxonium ion-initiated pinacolic ring expansion reactions. Application to the enantioselective synthesis of the spirocyclic sesquiterpene ethers dactyloxene-B and -C
    摘要:
    A convergent synthesis of dactyloxene-B (1) and -C (2) from a common optically active intermediate in seven steps has been achieved. Ozonolysis of(R)-(-)-linalool proceeded regioselectively to deliver a lactol, the benzoate of which when thermolyzed gave dihydrofuran 7. The second building block, levorotatory cyclopentanone 8, was produced by kinetically controlled lipase-induced hydrolysis of chloroacetate 15b. Saponification and oxidation of the less reactive ester was sufficient to provide (-)-8 whose condensation with the cerate of 7 gave rise to 19 and set the stage for implementation of the key structural rearrangement step. When stirred with Dowex resin, 19 was isomerized to four ketones. Following chromatographic separation, 20 and 21 were independently transformed into the target molecules via a two-step sequence. The spectral and optical properties of the two dactyloxenes compared very favorably with those reported earlier.
    DOI:
    10.1021/jo00106a033
  • 作为产物:
    参考文献:
    名称:
    FIELD, L. D.;GALLAGHER, S. P., TETRAHEDRON LETT., 1985, 26, N 49, 6125-6128
    摘要:
    DOI:
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文献信息

  • COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME
    申请人:Komatsuki Yasuhiro
    公开号:US20110081393A1
    公开(公告)日:2011-04-07
    Disclosed is a cooling sensation agent composition or sensory stimulation agent composition which contains at least one of diester compounds of dicarboxylic acid represented by the formula (1) wherein A represents CH 2 or CH═CH, n represents an integer of 0 to 4 when A is CH 2 , or 1 when A is CH═CH, B is an alcohol residue having 10 to 18 carbon atoms and containing a para-menthane skeleton, which may have a substituent, and C is an alcohol residue having 6 to 18 carbon atoms, which may have a substituent as well as a flavor or fragrance composition, a beverage, a food product, a perfume or cosmetic product, a toiletry product, daily utensil products or groceries, a fiber, a fiber product, clothes, clothing or a medicine, wherein the cooling sensation agent composition or the sensory stimulation agent composition is compounded.
    本文披露了一种包含以下化学式(1)所代表的二羧酸双酯化合物之一的冷却感剂组合物或感官刺激剂组合物,其中A代表CH2或CH═CH,n代表整数0至4(当A为CH2时)或1(当A为CH═CH时),B是含有10至18个碳原子并含有对蒎烷骨架的醇残基,可能有取代基,C是含有6至18个碳原子的醇残基,可能也有取代基,以及香料或香精组合物、饮料、食品产品、香水或化妆品产品、洗涤用品、日用品或杂货、纤维、纤维制品、衣服、服装或药品,其中复合了冷却感剂组合物或感官刺激剂组合物。
  • NOVEL PHARMACEUTICAL
    申请人:Takeda Pharmaceutical Company Limited
    公开号:EP1987827A1
    公开(公告)日:2008-11-05
    A tissue-selective androgen receptor modulator containing a compound represented by the formula wherein Ring A represents an optionally substituted 5- to 8-membered ring, Ring B represents an optionally further substituted 4- to 10-membered ring, Ring C represents an optionally further substituted benzene ring, X1 represents an optionally substituted carbon atom, X2 represents an optionally substituted carbon atom, an oxygen atom and the like, W1 represents a nitrogen atom and the like, Y11 represents a group represented by the formula CR2R3' (wherein R2 represents a hydrogen atom, a cyano group, a nitro group and the like, and R3' represents a bond, a hydrogen atom, a cyano group, a nitro group and the like, respectively), Y21 represents a group represented by the formula CR4R5' (wherein R4 represents a hydrogen atom, a cyano group, a nitro group and the like, and R5' represents a bond, a hydrogen atom, a cyano group, a nitro group and the like, respectively) and the like, R1 represents an electron-withdrawing group, and the formula - - - represents a single bond or a double bond, or a salt thereof or a prodrug thereof.
    一种组合物,包含一种组分,该组分的结构式如下:其中,环A代表一个可选取代的5-至8环,环B代表一个可选进一步取代的4-至10环,环C代表一个可选进一步取代的苯环,X1代表一个可选取代的碳原子,X2代表一个可选取代的碳原子、氧原子等,W1代表一个氮原子等,Y11代表一个由式CR2R3'(其中,R2代表氢原子、氰基、硝基等,R3'分别代表键、氢原子、氰基、硝基等)表示的基团,Y21代表一个由式CR4R5'(其中,R4代表氢原子、氰基、硝基等,R5'分别代表键、氢原子、氰基、硝基等)表示的基团等,R1代表一个电子吸引基团,而式- - -表示单键或双键,或其盐或前药。
  • Novel Pharmaceutical
    申请人:Yamaoka Masuo
    公开号:US20090042857A1
    公开(公告)日:2009-02-12
    A tissue-selective androgen receptor modulator containing a compound represented by the formula wherein Ring A represents an optionally substituted 5- to 8-membered ring, Ring B represents an optionally further substituted 4- to 10-membered ring, Ring C represents an optionally further substituted benzene ring, X 1 represents an optionally substituted carbon atom, X 2 represents an optionally substituted carbon atom, an oxygen atom and the like, W 1 represents a nitrogen atom and the like, Y 11 represents a group represented by the formula CR 2 R 3′ (wherein R 2 represents a hydrogen atom, a cyano group, a nitro group and the like, and R 3′ represents a bond, a hydrogen atom, a cyano group, a nitro group and the like, respectively), Y 21 represents a group represented by the formula CR 4 R 5′ (wherein R 4 represents a hydrogen atom, a cyano group, a nitro group and the like, and R 5′ represents a bond, a hydrogen atom, a cyano group, a nitro group and the like, respectively) and the like, R 1 represents an electron-withdrawing group, and the formula represents a single bond or a double bond, or a salt thereof or a prodrug thereof.
    一种组合物的组成式,该组合物是一种组织选择性的雄激素受体调节剂,其中环A代表可选取代的5-至8-环,环B代表可选取代的4-至10-环,环C代表可选取代的苯环,X1代表可选取代的碳原子,X2代表可选取代的碳原子、氧原子等,W1代表氮原子等,Y11代表由式CR2R3'(其中R2代表氢原子、氰基、硝基等,R3'代表键、氢原子、氰基、硝基等,分别)表示的基团,Y21代表由式CR4R5'(其中R4代表氢原子、氰基、硝基等,R5'代表键、氢原子、氰基、硝基等,分别)表示的基团等,R1代表电子吸引基团,式表示单键或双键,或其盐或前药。
  • METHOD FOR PRODUCING CARBOXYLIC ACID
    申请人:National Institute of Advanced Industrial Science and Technology
    公开号:EP1544190A1
    公开(公告)日:2005-06-22
    The present invention provides a safe, convenient and efficient method for producing carboxylic acid by a reaction of alicyclic alcohol with an aqueous hydrogen peroxide to thereby obtain carboxylic acid in high yield from alicyclic alcohol or alicyclic ketone under mild reaction conditions, wherein the reaction operation is simple and easy, a step for removing solvent after completion of the reaction is not necessary and influence and toxicity upon the environment and human body are markedly small. In order to provide it, an oily alicyclic alcohol is allowed to react with an aqueous hydrogen peroxide in the presence of a catalyst containing a metal compound belonging to Group 6 of the Periodic Table in a heterogeneous solution system.
    本发明提供了一种安全、方便、高效的生产羧酸的方法,该方法通过脂环醇与过氧化氢水溶液反应,从而在温和的反应条件下,从脂环醇或脂环酮中高产率地获得羧酸,反应操作简单易行,反应完成后无需去除溶剂的步骤,对环境和人体的影响和毒性明显较小。为了实现这一目标,需要在一个异相溶液体系中,在含有元素周期表第 6 族金属化合物的催化剂存在下,使油性脂环醇与过氧化氢水溶液发生反应。
  • AMINE DERIVATIVE HAVING NPY Y5 RECEPTOR ANTAGONIST ACTIVITY AND USE THEREOF
    申请人:Shionogi&Co., Ltd.
    公开号:EP2221051A1
    公开(公告)日:2010-08-25
    This invention provides an anorectic or anti-obesity composition comprising a compound of the formula (I); a pharmaceutically acceptable salt or solvate thereof, wherein R1 is optionally substituted lower alkyl, Y is -S(O)n- wherein n is 1 or 2, or -CO-, R2 is hydrogen or lower alkyl, R7 is hydrogen or lower alkyl, X is lower alkylene, lower alkenylene, arylene, cycloalkylene or the like, and Z is lower alkyl, optionally substituted carbocyclyl, optionally substituted heterocyclyl or the like.
    本发明提供了一种包含式(I)化合物的厌食或抗肥胖组合物; 其药学上可接受的盐或溶液、 其中 R1 是任选取代的低级烷基、 Y 是-S(O)n-,其中 n 是 1 或 2,或-CO-、 R2 是氢或低级烷基 R7 是氢或低级烷基 X 是低级烯烃、低级烯烃、芳烃、环烷烃或类似物,以及 Z 是低级烷基、任选取代的碳环烷基、任选取代的杂环烷基或类似物。
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