3-(3-溴-1,1-二甲基-丙-2-炔氧基)-丙酸 | 100379-15-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 3-(3-溴-1,1-二甲基-丙-2-炔氧基)-丙酸
• 英文名称: 3-(3-bromo-1,1-dimethyl-prop-2-ynyloxy)-propionic acid
• 英文别名: 3-(3-Brom-1,1-dimethyl-prop-2-inyloxy)-propionsaeure
• CAS: 100379-15-5
• 化学式: C₈H₁₁BrO₃
• 分子量: 235.078
• InChiKey: NBYIQOVGTGPYBU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.61
• 重原子数：
  12.0
• 可旋转键数：
  4.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  46.53
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  3-(3-溴-1,1-二甲基-丙-2-炔氧基)-丙酸 在 氯化亚砜 、 乙醚 、 氨 作用下， 生成 3-(3-bromo-1,1-dimethyl-prop-2-ynyloxy)-propionic acid amide
  参考文献：
  名称：

  Detecting photosynthetic algal pigments in natural populations using a high-spectral-resolution spectroradiometer

  摘要：

  Reflectance data from a high spectral resolution spectroradiometer were obtained onboard a ship in Plymouth coastal waters. These data were analysed to detect algal photosynthetic accessory pigments for comparison with absorption spectra as measured in the laboratory by a spectrophotometer. The overall spectral characteristics of Plymouth waters allowed identification as to population composition, Derivative analysis of the spectra was used to resolve characteristic peaks of specific pigments. It was determined that chlorophyll pigments, a specific carotenoid and sea water absorption bands were detectable in the reflectance data. Absorption bands of photosynthetic and accessory pigments were assessed through chromatographic pigment analysis.

  DOI：

  10.1080/01431160120387
• 作为产物：
  描述：

  4-溴-2-甲基丁-3-炔-2-醇 在 盐酸 、 sodium hydroxide 作用下， 生成 3-(3-溴-1,1-二甲基-丙-2-炔氧基)-丙酸
  参考文献：
  名称：

  Detecting photosynthetic algal pigments in natural populations using a high-spectral-resolution spectroradiometer

  摘要：

  Reflectance data from a high spectral resolution spectroradiometer were obtained onboard a ship in Plymouth coastal waters. These data were analysed to detect algal photosynthetic accessory pigments for comparison with absorption spectra as measured in the laboratory by a spectrophotometer. The overall spectral characteristics of Plymouth waters allowed identification as to population composition, Derivative analysis of the spectra was used to resolve characteristic peaks of specific pigments. It was determined that chlorophyll pigments, a specific carotenoid and sea water absorption bands were detectable in the reflectance data. Absorption bands of photosynthetic and accessory pigments were assessed through chromatographic pigment analysis.

  DOI：

  10.1080/01431160120387