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N,N'-Bis-(2,4-dinitro-phenyl)-nonane-1,9-diamine | 54897-77-7

中文名称
——
中文别名
——
英文名称
N,N'-Bis-(2,4-dinitro-phenyl)-nonane-1,9-diamine
英文别名
N,N'-bis(2,4-dinitrophenyl)nonane-1,9-diamine
N,N'-Bis-(2,4-dinitro-phenyl)-nonane-1,9-diamine化学式
CAS
54897-77-7
化学式
C21H26N6O8
mdl
——
分子量
490.473
InChiKey
YHFCYHFEBOHHSV-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):
    5.57
  • 重原子数:
    35.0
  • 可旋转键数:
    16.0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.43
  • 拓扑面积:
    196.62
  • 氢给体数:
    2.0
  • 氢受体数:
    10.0

反应信息

  • 作为产物:
    参考文献:
    名称:
    Chromatographic approach to the measurement of the interstrand distance for some chiral bonded phases
    摘要:
    A series of homologus N,N'-bis(d,2-dinitrophenyl)-alpha,omega-diaminoalkanes (bis-DNP's) was chromatographed at various temperatures on pi-basic chiral stationary phases derived from N-(2-napthyl)alanine in order to determine the enthalpy and entropy of adsorption. The number of methylene groups in the bis-DNP's influences the ability of the terminal pi-acidic groups to interact simultaneously with neighboring strands of stationary phase, a process termed "bridging". When the number of methylene groups is optimal for bridging, the enthalpy of adsorption is most exothermic. The length of the bis-derivative required for optimal bridging is related to the interstrand distance. Optimal bridging occurs for the bis-DNP's having five methylene groups regardless of the extent of surface coverage of the silica for the surface coverage range investigated. This suggests that the strands are not randomly spaced on the silica, with interstrand distance being influenced only by surface coverage, but are instead clustered, the clusters having similar distributions of interstrand distances. Adsorption is more exothermic for phases of high surface coverages than for low. If interstrand spacing is independent of surface coverage but surface coverage affects the enthalpy of adsorption, t hen surface coverage must influence the cluster size, which then influences the average extent of solvation of a strand of bonded phase.
    DOI:
    10.1021/ac00001a003
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