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[Chloro(nitro)methyl]benzene | 25567-68-4

中文名称
——
中文别名
——
英文名称
[Chloro(nitro)methyl]benzene
英文别名
——
[Chloro(nitro)methyl]benzene化学式
CAS
25567-68-4
化学式
C7H6ClNO2
mdl
——
分子量
171.58
InChiKey
BVJSGOYEEDZAGW-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):
    2.4
  • 重原子数:
    11
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.14
  • 拓扑面积:
    45.8
  • 氢给体数:
    0
  • 氢受体数:
    2

文献信息

  • Depsipeptides and Their Therapeutic Use
    申请人:Shuttleworth Stephen Joseph
    公开号:US20110112090A1
    公开(公告)日:2011-05-12
    A Compound of structure (IX) or (X) or a pharmaceutically acceptable salt thereof, wherein: X is —C(═O)N(R 10 )— or —CH(OPr 3 )—; R 7 , R 9 and R 10 are the same or different and represent hydrogen or an amino acid side chain moiety from either a natural or an unnatural amino acid; Pr 1 and Pr 2 are the same or different and represent hydrogen or a thiol protecting group; Pr 3 is hydrogen or an alcohol protecting group; R 1 , R 2 , R 5 and R 6 are the same or different and represent hydrogen or an amino acid side chain moiety from either a natural or an unnatural amino acid, or R 1 and R 2 and/or R 5 and R 6 , taken together with the carbon atom to which they are attached, form a spirocyclic moiety, with the proviso that: each of R 1 and R 2 is not hydrogen, or each of R 5 and R 6 is not hydrogen.
    一种结构化合物(IX)或(X)或其药学上可接受的盐,其中:X为—C(═O)N(R10)—或—CH(OPr3)—;R7、R9和R10相同或不同,代表氢或来自天然或非天然氨基酸的氨基酸侧链基团;Pr1和Pr2相同或不同,代表氢或巯基保护基团;Pr3为氢或醇保护基团;R1、R2、R5和R6相同或不同,代表氢或来自天然或非天然氨基酸的氨基酸侧链基团,或R1和R2和/或R5和R6,与它们连接的碳原子一起形成螺环基团,条件是:R1和R2中的每一个都不是氢,或R5和R6中的每一个都不是氢。
  • [EN] METHOD OF CONVERTING ALCOHOL TO HALIDE<br/>[FR] PROCÉDÉ DE CONVERSION D'UN ALCOOL EN HALOGÉNURE
    申请人:UNIV SAARLAND
    公开号:WO2016202894A1
    公开(公告)日:2016-12-22
    The present invention relates to a method of converting an alcohol into a corresponding halide. This method comprises reacting the alcohol with an optionally substituted aromatic carboxylic acid halide in presence of an N-substituted formamide to replace a hydroxyl group of the alcohol by a halogen atom. The present invention also relates to a method of converting an alcohol into a corresponding substitution product. The second method comprises: (a) performing the method of the invention of converting an alcohol into the corresponding halide; and (b) reacting the corresponding halide with a nucleophile to convert the halide into the nucleophilic substitution product.
    本发明涉及一种将醇转化为相应卤化物的方法。该方法包括在N-取代甲酰胺的存在下,将醇与可选择取代的芳香羧酸卤化物反应,以通过卤原子取代醇的羟基。本发明还涉及一种将醇转化为相应取代产物的方法。第二种方法包括:(a)执行将醇转化为相应卤化物的本发明方法;以及(b)将相应卤化物与亲核试剂反应,将卤化物转化为亲核取代产物。
  • DIBENZOCYCLOHEPTATONE DERIVATIVES AND PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS
    申请人:Laufer Stefan
    公开号:US20120115862A1
    公开(公告)日:2012-05-10
    The present invention relates to compounds of the formula I wherein R1, R2, R3, R4, X and Y have the meanings given in the description. The compounds have an action which is immunomodulating and inhibits or regulates the release of IL-1β and/or TNF-α. They can therefore be used for treatment of diseases connected with a disturbance in the immune system.
    本发明涉及公式I中的化合物,其中R1、R2、R3、R4、X和Y的含义如描述中所述。这些化合物具有免疫调节作用,并抑制或调节IL-1β和/或TNF-α的释放。因此,它们可以用于治疗与免疫系统紊乱有关的疾病。
  • [EN] GLUCOSE-BASED COMPOUNDS WITH AFFINITY TO P-SELECTIN<br/>[FR] COMPOSES A BASE DE GLUCOSE PRESENTANT UNE AFFINITE POUR LA SELECTINE-P
    申请人:YAMANOUCHI EUROP BV
    公开号:WO2004033473A1
    公开(公告)日:2004-04-22
    The present invention relates to certain glucose-based compounds that have an affinity to P-selectin. Further, the invention relates to the use of these glucose-based compounds for the preparation of pharmaceutical compositions for the treatment of disorders associated with P-selectin, to conjugates, pharmaceutical carriers and drug delivery systems comprising said compounds, and to a method for determining whether a compound is capable of binding to P-selectin.
    本发明涉及某些基于葡萄糖的化合物,其具有与P-选择素的亲和性。此外,本发明涉及使用这些基于葡萄糖的化合物制备用于治疗与P-选择素相关的疾病的药物组合物,包括共轭物、药物载体和药物输送系统,以及一种确定化合物是否能够结合P-选择素的方法。
  • PROCESS FOR PREPARING ISOXAZOLE COMPOUNDS
    申请人:Godschalx James P.
    公开号:US20100048910A1
    公开(公告)日:2010-02-25
    A process for preparing isoxazole compounds of formula I: in which a nitroaryl of the formula (II): is contacted with an alkyl acetoacetate of the formula (III) or a salt thereof: in the presence of an activating agent and a base to provide the isoxazole compound.
    一种制备式I异噁唑化合物的方法: 其中,式(II)的硝基芳基与式(III)的烷基乙酰丙酮或其盐在活化剂和碱的存在下接触,从而提供异噁唑化合物。
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