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CS-W001157 4
Total: USD 88.00

Cucurbit[8]uril

  • CAS No. 259886-51-6

  • Cat. No. CS-0031079
  • Purity≥95%
  • MDL No.MFCD03456501

*For research and further manufacturing use only, not for direct human use.

Cucurbit[8]uril|CS-0031079

Structure of 259886-51-6

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General Information

  • CAS No. 259886-51-6
  • Cat. No. CS-0031079
  • Purity ≥95%
  • MDL No. MFCD03456501
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄₈H₄₈N₃₂O₁₆
  • Molecular Weight 1329.10
  • Synonym(s) None
  • SMILES O=C1N(CN(C2=O)[C@]([C@@]3([H])N2CN(C4=O)[C@]([C@@]5([H])N4CN(C6=O)[C@]([C@@]7([H])N6CN8[C@]9([H])N(C%10=O)CN%117)([H])N(C%11=O)CN%125)([H])N(C%12=O)CN3C%13=O)([H])N%13CN%14%15)[C@]%14([H])[C@]%16([H])N1CN(C%17=O)[C@@]([C@]%18([H])N%17CN(C%19=O)[C@@]([C@]%20([H])N%19CN(C%21=O)[C@@]([C@]%22([H])N%21CN%23C8=O)([H])N(C(N%22CN%10[C@]%239[H])=O)CN%24%20)([H])N(C%24=O)CN%18C%25=O)([H])N%25CN%16C%15=O

Application

Cucurbit[8]uril serves as a macrocyclic host for the selective encapsulation of linear aliphatic and aromatic guests, enabling supramolecular assembly through hydrophobic and ion-dipole interactions. Its large cavity facilitates stabilization of extended molecular frameworks, enhances solubility of hydrophobic compounds, and supports controlled release applications in drug delivery and catalysis. The compound exhibits robust aqueous stability and functions effectively in biologically relevant conditions.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   376.8
  • LogP   -7.552
  • H_Acceptors   16
  • H_Donors   0
  • Rotatable_Bonds   0

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