N-butyryl-D-valine | 74513-60-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: N-butyryl-D-valine
• 英文别名: (R)-2-Butyramido-3-methylbutanoic acid；(2R)-2-(butanoylamino)-3-methylbutanoic acid
• CAS: 74513-60-3；143896-77-9
• 化学式: C₉H₁₇NO₃
• 分子量: 187.239
• InChiKey: XFBGKIUQJKBFIO-MRVPVSSYSA-N

物化性质

• 沸点：
  378.8±25.0 °C(Predicted)
• 密度：
  1.049±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  66.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-butyryl-D-valine 、 N-(6-methylpyridin-2-yl)-3-(propanoylamino)benzamide 以 氘代氯仿 为溶剂， 生成
  参考文献：
  名称：

  Molecular recognition: directed hydrogen bonding receptors for acylamino acid carboxylates

  摘要：

  A new series of receptors for acylamino acid carboxylates has been synthesized and shown to have increased binding affinity for the substrate as the number of hydrogen bonding groups in the cavity increases.

  DOI：

  10.1016/s0040-4039(00)74235-3
• 作为产物：
  描述：

  以 氘代氯仿 为溶剂， 生成 N-butyryl-D-valine 、 N-(6-methylpyridin-2-yl)-3-(propanoylamino)benzamide
  参考文献：
  名称：

  Molecular recognition: directed hydrogen bonding receptors for acylamino acid carboxylates

  摘要：

  A new series of receptors for acylamino acid carboxylates has been synthesized and shown to have increased binding affinity for the substrate as the number of hydrogen bonding groups in the cavity increases.

  DOI：

  10.1016/s0040-4039(00)74235-3

文献信息

• Molecular recognition: directed hydrogen bonding receptors for acylamino acid carboxylates
  作者：Cristina Vicent、Erkang Fan、Andrew D. Hamilton

  DOI：10.1016/s0040-4039(00)74235-3

  日期：1992.7

  A new series of receptors for acylamino acid carboxylates has been synthesized and shown to have increased binding affinity for the substrate as the number of hydrogen bonding groups in the cavity increases.