2,2-bis-hydroxymethyl-pentan-3-one | 856339-45-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2,2-bis-hydroxymethyl-pentan-3-one
• 英文别名: 2-Methyl-2-propionyl-propandiol-(1.3)；2,2-Bis-hydroxymethyl-pentan-3-on；1-Hydroxy-2-(hydroxymethyl)-2-methylpentan-3-one；1-hydroxy-2-(hydroxymethyl)-2-methylpentan-3-one
• CAS: 856339-45-2
• 化学式: C₇H₁₄O₃
• 分子量: 146.186
• InChiKey: ZFEUWISDUOPKNS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.6
• 重原子数：
  10
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  57.5
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2,2-bis-hydroxymethyl-pentan-3-one 、 氢溴酸 、 溶剂黄146 生成 alkaline earth salt of/the/ methylsulfuric acid
  参考文献：
  名称：

  Model of Detergent-Induced Spectral Changes of the B800-850 Complex from Chromatium minutissimum

  摘要：

  The absorption and circular dichroism spectra of the B800-850 complex from Chromatium minutissimum before and after the Triton X-100 treatment were simulated by means of standard exciton theory, taking into account inhomogeneous broadening. To explain the spectral changes of the B800-850 complex treated with Triton X-100, we have assumed that all bacteriochlorophyll pigments absorbing at 850 nm exhibit the same additional rotation of similar to 20 degrees around the axis perpendicular to the membrane plane. This has been sufficient to fit the transformation in absorption and circular dichroism spectra induced by detergent treatment of the B800-850 complex.

  DOI：

  10.1080/15216540050212123
• 作为产物：
  描述：

  聚合甲醛 、 3-戊酮 在 sodium hydroxide 作用下， 生成 2,2-bis-hydroxymethyl-pentan-3-one
  参考文献：
  名称：

  399.甲醛与脂肪族酮的缩合。第一部分

  摘要：

  DOI：

  10.1039/jr9320002667

文献信息

• [EN] COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS<br/>[FR] ASSOCIATIONS D'INHIBITEURS DU VIRUS DE L'HÉPATITE C
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2015005901A1

  公开（公告）日：2015-01-15

  The present disclosure is generally directed to antiviral compounds, and more specifically directed to combinations of compounds which can inhibit the function of the NS5A protein encoded by Hepatitis C virus (HCV), compositions comprising such combinations, and methods for inhibiting the function of the NS5A protein.

  本公开涉及抗病毒化合物，更具体地涉及能够抑制由丙型肝炎病毒（HCV）编码的NS5A蛋白功能的化合物组合，包括这种组合的组合物，以及抑制NS5A蛋白功能的方法。
• 399. Formaldehyde condensations with aliphatic ketones. Part I
  作者：Gilbert T. Morgan、Eric Leighton Holmes

  DOI：10.1039/jr9320002667

  日期：——
• Absorbent member for absorbent articles comprising swellable polymers of high permeability which are capable of forming hydrogels
  申请人：THE PROCTER & GAMBLE COMPANY

  公开号：EP1588723B1

  公开（公告）日：2009-06-03
• POLYIONIC DENDRIMER AND HYDROGEL COMPRISING SAME
  申请人：Japan Science and Technology Agency

  公开号：EP2450392B1

  公开（公告）日：2014-06-25
• [EN] HEPATITIS C VIRUS INHIBITORS<br/>[FR] INHIBITEURS DU VIRUS DE L'HÉPATITE C
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2013106520A1

  公开（公告）日：2013-07-18

  The present disclosure is generally directed to antiviral compounds, and more specifically directed to combinations of compounds which can inhibit the function of the NS5A protein encoded by Hepatitis C virus (HCV), compositions comprising such combinations, and methods for inhibiting the function of the NS5A protein.