3-Oct-1-ynyl-benzaldehyde | 307498-19-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-Oct-1-ynyl-benzaldehyde
• 英文别名: 3-Oct-1-ynylbenzaldehyde；3-oct-1-ynylbenzaldehyde
• CAS: 307498-19-7
• 化学式: C₁₅H₁₈O
• 分子量: 214.307
• InChiKey: FNNOSBKBQPZBQV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  16
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-Oct-1-ynyl-benzaldehyde 在 palladium/alumina 氢气 作用下， 以 乙酸乙酯 为溶剂， 以78%的产率得到3-octylbenzaldehyde
  参考文献：
  名称：

  Syntheses and antifungal activity of pseudomycin side-chain analogues. Part 1

  摘要：

  We have described herein the syntheses of three novel series of aromatic ring containing pseudomycin side-chain analogues. Preliminary biological evaluations of these analogues clearly indicate that it is possible to synthesize rigid pseudomycin sidechain analogues without compromising in vitro antifungal activity. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00423-6
• 作为产物：
  描述：

  间溴苯甲醛 、 1-辛炔 在 copper(l) iodide 、 TEA 、 三苯基膦 、 palladium dichloride 作用下， 以 乙腈 为溶剂， 以51%的产率得到3-Oct-1-ynyl-benzaldehyde
  参考文献：
  名称：

  Syntheses and antifungal activity of pseudomycin side-chain analogues. Part 1

  摘要：

  We have described herein the syntheses of three novel series of aromatic ring containing pseudomycin side-chain analogues. Preliminary biological evaluations of these analogues clearly indicate that it is possible to synthesize rigid pseudomycin sidechain analogues without compromising in vitro antifungal activity. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00423-6

文献信息

• Arachidonic acid analogues
  申请人：BEECHAM GROUP PLC

  公开号：EP0207599A1

  公开（公告）日：1987-01-07

  Compounds of formula (I): or, where appropriate, a solt or amide thereof, wherein R' is hydrogen or C1-6 alkyl; R2 is hydrogen or CO2R3 where R3 is hydrogen or C1-8 alkyl; X and X' are independently a double or triple bond; A and B are hydrogen when X is a double bond or A and B are both absent when X is a triple bond; A' and B' are hydrogen when X' is a double bond or A' and B' are both absent when X' is a triple bond; n is 0 or an integer of from 1 to 4; and m is an integer of from 2 to 7; processes for preparing such compounds; pharmaceutical compositions containing such compounds and the use of such compounds and compositions in medicine.

  式(I)化合物： 或（如适用）其溶液或酰胺，其中 R' 为氢或 C1-6 烷基；R2 为氢或 CO2R3，其中 R3 为氢或 C1-8 X和X'独立地为双键或三键；当X为双键时，A和B为氢，或当X为三键时，A和B都不存在。 当 X 是三键时，A 和 B 都不存在；当 X' 是双键时，A'和 B'是氢，或当 X' 是三键时，A'和 B'都不存在； n为0或1至4的整数；m为2至7的整数；制备此类化合物的工艺；含有此类化合物的药物组合物以及此类化合物和组合物在医药中的用途。
• Syntheses and antifungal activity of pseudomycin side-chain analogues. Part 1
  作者：James Jamison、Stuart Levy、Xicheng Sun、Doug Zeckner、William Current、Mark Zweifel、Michael Rodriguez、William Turner、Shu-Hui Chen

  DOI：10.1016/s0960-894x(00)00423-6

  日期：2000.9

  We have described herein the syntheses of three novel series of aromatic ring containing pseudomycin side-chain analogues. Preliminary biological evaluations of these analogues clearly indicate that it is possible to synthesize rigid pseudomycin sidechain analogues without compromising in vitro antifungal activity. (C) 2000 Elsevier Science Ltd. All rights reserved.