4,6-二氟-1a,2,3,7b-四氢-1-噁-环丙[a]萘 | 939760-68-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 中文名称: 4,6-二氟-1a,2,3,7b-四氢-1-噁-环丙[a]萘
• 英文名称: 4,6-Difluoro-1a,2,3,7b-tetrahydronaphtho[1,2-b]oxirene
• CAS: 939760-68-6
• 化学式: C₁₀H₈F₂O
• mdl: MFCD08544508
• 分子量: 182.17
• InChiKey: KVJPPMVAVGSMGH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4,6-二氟-1a,2,3,7b-四氢-1-噁-环丙[a]萘 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 生成 5,7-difluorotetralol
  参考文献：
  名称：

  Kinetic enzymatic resolution of β-tetralols

  摘要：

  Several substituted beta-tetralols 1a-e and beta-tetralol 2 were successfully resolved using porcine pancreatin in hydrocarbon solvents. All attempts to resolve the substituted beta-tetralols by diasteromeric derivatization have failed. The absolute configuration of the products was established by literature precedence.

  DOI：

  10.1016/0957-4166(95)00180-w
• 作为产物：
  描述：

  5,7-二氟-3,4-二氢-2H-萘-1-酮 在 sodium tetrahydroborate 、 对甲苯磺酸 、 间氯过氧苯甲酸 作用下， 以 甲醇 、 氯仿 、 苯 为溶剂， 生成 4,6-二氟-1a,2,3,7b-四氢-1-噁-环丙[a]萘
  参考文献：
  名称：

  Kinetic enzymatic resolution of β-tetralols

  摘要：

  Several substituted beta-tetralols 1a-e and beta-tetralol 2 were successfully resolved using porcine pancreatin in hydrocarbon solvents. All attempts to resolve the substituted beta-tetralols by diasteromeric derivatization have failed. The absolute configuration of the products was established by literature precedence.

  DOI：

  10.1016/0957-4166(95)00180-w

文献信息

• Kinetic enzymatic resolution of β-tetralols
  作者：Gregory R. Martinez

  DOI：10.1016/0957-4166(95)00180-w

  日期：1995.7

  Several substituted beta-tetralols 1a-e and beta-tetralol 2 were successfully resolved using porcine pancreatin in hydrocarbon solvents. All attempts to resolve the substituted beta-tetralols by diasteromeric derivatization have failed. The absolute configuration of the products was established by literature precedence.