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4-methyl-2-[[(2S)-5-oxopyrrolidin-2-yl]methyl]benzenesulfonic acid

中文名称
——
中文别名
——
英文名称
4-methyl-2-[[(2S)-5-oxopyrrolidin-2-yl]methyl]benzenesulfonic acid
英文别名
——
4-methyl-2-[[(2S)-5-oxopyrrolidin-2-yl]methyl]benzenesulfonic acid化学式
CAS
——
化学式
C12H15NO4S
mdl
——
分子量
269.32
InChiKey
MWGUVKSKQQPROV-JTQLQIEISA-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):
    0.7
  • 重原子数:
    18
  • 可旋转键数:
    3
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.42
  • 拓扑面积:
    91.8
  • 氢给体数:
    2
  • 氢受体数:
    4

文献信息

  • TRANSITION METAL COMPLEXES FOR ENANTIOSELECTIVE CATALYSIS OF CARBON-CARBON, CARBON-HETEROATOM, AND CARBON-HYDROGEN BOND FORMING REACTIONS
    申请人:THE TEXAS A&M UNIVERSITY SYSTEM
    公开号:US20150165429A1
    公开(公告)日:2015-06-18
    In some embodiments, the present disclosure pertains to a compound, comprising a transition metal complex having the formula Φ-[M(x,y)-L 1 (w,v)-L 2 (t,u)-L 3 ] p+ An − m Z − p — m . In an embodiment of the present disclosure Φ may be A. In another embodiment Φ may be Δ. In some embodiments of the present disclosure, M is a transition metal. In a related embodiment, p is an integer corresponding to the oxidation state of M. In some embodiments of the present disclosure, each of x, y, w, v, t, and u independently comprise R. In other embodiments, each of x, y, w, v, t, and u independently comprise S. In an embodiment of the present disclosure, each of L 1 , L 2 , and L 3 independently is a ligand comprising a substituted diamine. In some embodiments, An″ comprises a lipophilic anion, where m is from 1 to 3, and where Z − comprises an optional second anion.
    在某些实施例中,本公开涉及一种化合物,包括具有公式Φ-[M(x,y)-L1(w,v)-L2(t,u)-L3]p+An−mZ−p—m的过渡金属配合物。在本公开的某种实施例中,Φ可以是A。在另一种实施例中,Φ可以是Δ。在本公开的某些实施例中,M是一种过渡金属。在相关实施例中,p是与M的氧化态相对应的整数。在本公开的某些实施例中,x,y,w,v,t和u中的每个都独立地包括R。在其他实施例中,x,y,w,v,t和u中的每个都独立地包括S。在本公开的某种实施例中,L1、L2和L3中的每个都独立地是包含取代二胺的配体。在某些实施例中,An″包括一个亲脂性阴离子,其中m从1到3,而Z−包括一个可选的第二个阴离子。
  • Transition metal complexes for enantioselective catalysis of carbon-carbon, carbon-heteroatom, and carbon-hydrogen bond forming reactions
    申请人:Lewis Kyle G.
    公开号:US10189871B2
    公开(公告)日:2019-01-29
    In some embodiments, the present disclosure pertains to a compound, comprising a transition metal complex having the formula Φ-[M (x,y)-L1 (w,v)-L2 (t,u)-L3]p+An−mZ−p−m. In an embodiment of the present disclosure Φ may be Λ. In another embodiment Φ may be Δ. In some embodiments of the present disclosure, M is a transition metal. In a related embodiment, p is an integer corresponding to the oxidation state of M. In some embodiments of the present disclosure, each of x, y, w, v, t, and u independently comprise R. In other embodiments, each of x, y, w, v, t, and u independently comprise S. In an embodiment of the present disclosure, each of L1, L2, and L3 independently is a ligand comprising a substituted diamine. In some embodiments, An− comprises a lipophilic anion, where m is from 1 to 3, and where Z− comprises an optional second anion.
    在一些实施方案中,本公开涉及一种化合物,该化合物包含具有式 Φ-[M (x,y)-L1 (w,v)-L2 (t,u)-L3]p+An-mZ-p-m 的过渡金属配合物。在本公开的一个实施方案中,Φ 可以是Λ。在本公开的一些实施方案中,M 是过渡金属。在本公开的一些实施方案中,x、y、w、v、t和u中的每一个独立地包括R。在其它实施方案中,x、y、w、v、t和u中的每一个独立地包括S。在本公开的一个实施方案中,L1、L2和L3中的每一个独立地是包括取代二胺的配体。在一些实施方案中,An-包括亲脂阴离子,其中m为1至3,Z-包括任选的第二阴离子。
  • US9446393B2
    申请人:——
    公开号:US9446393B2
    公开(公告)日:2016-09-20
  • [EN] TRANSITION METAL COMPLEXES FOR ENANTIOSELECTIVE CATALYSIS OF CARBON-CARBON, CARBON-HETEROATOM, AND CARBON-HYDROGEN BOND FORMING REACTIONS<br/>[FR] COMPLEXES DE MÉTAL DE TRANSITION POUR LA CATALYSE ÉNANTIOSÉLECTIVE DE RÉACTIONS DE FORMATION DE LIAISONS CARBONE-CARBONE, CARBONE-HÉTÉROATOME ET CARBONE-HYDROGÈNE
    申请人:TEXAS A & M UNIV SYS
    公开号:WO2014018978A2
    公开(公告)日:2014-01-30
    In some embodiments, the present disclosure pertains to a compound, comprising a transition metal complex having the formula Φ-[Μ (x,y)-L1 (w,v)-L2 (t,u)-L3]p+An-mZ-p_m. In an embodiment of the present disclosure Φ may be A. In another embodiment Φ may be Δ. In some embodiments of the present disclosure, M is a transition metal. In a related embodiment, p is an integer corresponding to the oxidation state of M. In some embodiments of the present disclosure, each of x, y, w, v, t, and u independently comprise R. In other embodiments, each of x, y, w, v, t, and u independently comprise S. In an embodiment of the present disclosure, each of L1, L2, and L3 independently is a ligand comprising a substituted diamine. In some embodiments, An" comprises a lipophilic anion, where m is from 1 to 3, and where Z- comprises an optional second anion.
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