Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin
TL;DR: Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin (CAS 110934-22-0) is a chemical compound with molecular formula C72H128O40 and molecular weight 1632.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3S,5R,6R,8S,10R,11R,13S,15R,16R,18S,20R,21R,23S,25R,26R,28S,30R,31R,33S,35R,36R,38S,40R,41S,42R,43S,44R,45S,46R,47S,48R,49S,50R,51S,52R,53S,54R,55S,56R)-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecamethoxy-5,10,15,20,25,30,35,40-octakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane
Also Known As: nchembio793-comp2, Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin, Octakis (2,3,6-tri-O-methyl)-, A-cyclodextrin
| Molecular Formula | C72H128O40 |
|---|---|
| Molecular Weight | 1632.80 g/mol |
| LogP | -1.708 |
| Topological Polar Surface Area | 369.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 40 |
| Rotatable Bonds | 32 |
| Exact Mass | 1632.7982 |
| Heavy Atoms | 112 |
| Complexity | 2085.1306 |
Chemical Identifiers
| CAS Number | 110934-22-0 |
|---|---|
| SMILES | COC[C@@H]1[C@@H]2[C@@H]([C@H]([C@@H](O1)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3OC)OC)O[C@@H]4[C@H](O[C@H]([C@@H]([C@H]4OC)OC)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5OC)OC)O[C@@H]6[C@H](O[C@H]([C@@H]([C@H]6OC)OC)O[C@@H]7[C@H](O[C@H]([C@@H]([C@H]7OC)OC)O[C@@H]8[C@H](O[C@H]([C@@H]([C@H]8OC)OC)O[C@@H]9[C@H](O[C@@H](O2)[C@@H]([C@H]9OC)OC)COC)COC)COC)COC)COC)COC)COC)OC)OC |
Product Overview
Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin (CAS 110934-22-0), with molecular formula C72H128O40 and molecular weight 1632.80 g/mol. IUPAC: (1R,3S,5R,6R,8S,10R,11R,13S,15R,16R,18S,20R,21R,23S,25R,26R,28S,30R,31R,33S,35R,36R,38S,40R,41S,42R,43S,44R,45S,46R,47S,48R,49S,50R,51S,52R,53S,54R,55S,56R)-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecamethoxy-5,10,15,20,25,30,35,40-octakis(methoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane.
Chemical Property Profile of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin
Property Insights of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin
The XLogP value of -1.708 indicates that Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 369.2 Ų indicates high polarity, suggesting Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin has 0 hydrogen bond donor(s) and 40 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin?
The CAS number of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin is 110934-22-0.
What is the molecular formula of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin?
The molecular formula of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin is C72H128O40.
What is the molecular weight of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin?
The molecular weight of Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin is 1632.80 g/mol.
Where can I buy Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin?
You can request a quote for Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin?
Yes, KEHONG BIO provides custom synthesis services for Octakis(2,3,6-tri-O-Methyl)-gamma-cyclodextrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.