Iota-cyclodextrin | 156510-94-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Iota-cyclodextrin
• 英文别名: (1R,3S,4R,6R,8S,9R,11R,13S,14R,16R,18S,19R,21R,23S,24R,26R,28S,29R,31R,33S,34R,36R,38S,39R,41R,43S,44R,46R,48S,49R,51R,53S,54R,56R,58S,59R,61R,63S,64R,66R,68S,69R,71R,72R,73R,74R,75R,76R,77R,78R,79R,80R,81R,82R,83R,84R,85R,86R,87R,88R,89R,90R,91R,92R,93R,94R,95R,96R,97R,98R)-4,9,14,19,24,29,34,39,44,49,54,59,64,69-tetradecakis(hydroxymethyl)-2,5,7,10,12,15,17,20,22,25,27,30,32,35,37,40,42,45,47,50,52,55,57,60,62,65,67,70-octacosaoxapentadecacyclo[66.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36.238,41.243,46.248,51.253,56.258,61.263,66]octanonacontane-71,72,73,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98-octacosol
• CAS: 156510-94-0
• 化学式: C₈₄H₁₄₀O₇₀
• 分子量: 2270.0
• InChiKey: MZYYMHBTALLPBX-WUGKIVSMSA-N

物化性质

• 密度：
  1.624±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -30
• 重原子数：
  154
• 可旋转键数：
  14
• 环数：
  54.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  1110
• 氢给体数：
  42
• 氢受体数：
  70