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(4-Nitrophenyl)methanesulfonate

中文名称
——
中文别名
——
英文名称
(4-Nitrophenyl)methanesulfonate
英文别名
——
(4-Nitrophenyl)methanesulfonate化学式
CAS
——
化学式
C7H6NO5S-
mdl
——
分子量
216.19
InChiKey
VWLGQKLHWIVCCZ-UHFFFAOYSA-M
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):
    0.7
  • 重原子数:
    14
  • 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:
    111
  • 氢给体数:
    0
  • 氢受体数:
    5

文献信息

  • Method for Manufacture of 2-Oxoimidazolidines
    申请人:Peterson John R.
    公开号:US20100222588A1
    公开(公告)日:2010-09-02
    There is provided a method for manufacture of 2-oxoimidazolidines of Formula I comprising one or more of the steps of converting an amine to an acylation agent, condensation of the acylation agent with a bi-functional compound of structure L-C(R 4 )(R 5 )—C(R 2 )(R 3 )—NHR 1 , wherein L is a leaving group, and ring closure of the resulting urea. In this manner, certain 2-oxoimidazolidines may be manufactured that are useful intermediates for the production of Pramiconazole and structurally related compounds.
    提供了一种制备式I的2-氧代咪唑啉的方法,包括以下一项或多项步骤:将胺转化为酰化剂,将酰化剂与结构为L-C(R4)(R5)—C(R2)(R3)—NHR1的双功能化合物缩合,其中L是一个离去基团,并闭环生成的脲。通过这种方式,可以制备出一些对于生产Pramiconazole和结构相关化合物有用的2-氧代咪唑啉中间体。
  • Process for production of delta-9- tetrahydrocannabinol
    申请人:Burdick C. David
    公开号:US20070093665A1
    公开(公告)日:2007-04-26
    The present invention relates to a process for preparation of a delta-9-tetrahydrocannabinol compound or derivative thereof involving treating a first intermediate compound with an organoaluminum-based Lewis acid catalyst, under conditions effective to produce the delta-9-tetrahydrocannabinol compound or derivative thereof. Another aspect of the present invention relates to a process for preparation of a cannabidiol or cannabidiolate compound involving reacting a first starting compound with a second starting compound in the presence of a metal triflate catalyst, under conditions effective to form the cannabidiol or cannabidiolate compound. The present invention also relates to a compound of the formula: where R 8 , R 9 , and R 10 are the same or different and independently selected from the group consisting of H, substituted or unsubstituted alkyl, substituted or unsubstituted aryl, substituted or unsubstituted heteroaryl, or halo, with R 1 , R 2 , and R 3 defined herein.
    本发明涉及一种制备Δ-9-四氢大麻酚化合物或其衍生物的方法,涉及将第一中间化合物与基于有机铝的Lewis酸催化剂处理,在有效条件下产生Δ-9-四氢大麻酚化合物或其衍生物。本发明的另一个方面涉及一种制备大麻二酚或大麻二酚盐化合物的方法,涉及在金属三氟甲磺酸盐催化剂存在下,将第一起始化合物与第二起始化合物反应,在有效条件下形成大麻二酚或大麻二酚盐化合物。本发明还涉及一个化合物,其化学式为:其中R8、R9和R10相同或不同,并且独立地选自H、取代或未取代的烷基、取代或未取代的芳基、取代或未取代的杂环芳基或卤素,其中R1、R2和R3在此定义。
  • PREPARATION AND UTILITY OF SUBSTITUTED INDOLES
    申请人:Gant G. Thomas
    公开号:US20080103189A1
    公开(公告)日:2008-05-01
    Disclosed herein are substituted indoles of Formula I, processes of preparation there of, pharmaceutical compositions thereof, and methods of their use there of.
    本文揭示了公式I的取代吲哚化合物,其制备方法,药物组合物以及它们的使用方法。
  • Process for Manufacture of Optically Active 2-(Acyloxymethyl)-1,3-Oxathiolanes
    申请人:Peterson John R.
    公开号:US20100143978A1
    公开(公告)日:2010-06-10
    There is provided a process for manufacture of optically-active, 2-(acyloxymethyl)-1,3-oxathiolanes of Formula I comprising a preparation of a racemic compound and an enzyme-catalyzed kinetic resolution of the enantiomers. The invention may further provide for the esterification and racemization of the by-product of the enzymatic reaction. In this manner, 2(R)-(benzoyloxymethyl)-1,3-oxathiolane is prepared as a useful intermediate for manufacture of the anti-HIV drug Apricitabine.
    提供了一种制备光学活性的2-(酰氧甲基)-1,3-噁硫烷酮(式I)的方法,包括制备外消旋化合物和酶催化对映体的动力学分辨。本发明还可以进一步提供酯化和酶催化反应的副产物的外消旋化。通过这种方式,制备出2(R)-(苯甲酰氧甲基)-1,3-噁硫烷酮作为制造抗HIV药物Apricitabine的有用中间体。
  • Processes for the production of cannabidiol derivatives and intermediates thereof
    申请人:Albany Molecular Research, Inc.
    公开号:EP2578561A1
    公开(公告)日:2013-04-10
    This invention relates to a process for the preparation of a product compound of the formula: wherein: R1 is H, substituted or unsubstituted alkyl, carboxylic ester, or acyl; R2 is H, OH, protected hydroxyl, substituted or unsubstituted alkyl, alkenyl, alkynyl, acyl, aryl, or heteroaryl; R3 is H, substituted or unsubstituted alkyl, carboxylic ester, or acyl; R4 is H, substituted or unsubstituted alkyl, silyl, hetero-substituted or unsubstituted acyl, alkylsulfonyl, arylsulfonyl, alkylphosphoryl, or arylphosphoryl; and R6 is H, substituted or unsubstituted alkyl, silyl, hetero-substituted or unsubstituted acyl, alkylsulfonyl, arylsulfonyl, alkylphosphoryl, or arylphosphoryl.
    本发明涉及一种制备公式化合物的过程:其中:R1为氢,取代或未取代烷基,羧酸酯或酰基;R2为氢,羟基,保护羟基,取代或未取代烷基,烯基,炔基,酰基,芳基或杂环芳基;R3为氢,取代或未取代烷基,羧酸酯或酰基;R4为氢,取代或未取代烷基,硅基,杂原子取代或未取代酰基,烷基磺酰基,芳基磺酰基,烷基磷酰基或芳基磷酰基;R6为氢,取代或未取代烷基,硅基,杂原子取代或未取代酰基,烷基磺酰基,芳基磺酰基,烷基磷酰基或芳基磷酰基。
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