alpha-Cyclodextrin, dodecakis(hydrogen sulfate)
TL;DR: alpha-Cyclodextrin, dodecakis(hydrogen sulfate) (CAS 120825-95-8) is a chemical compound with molecular formula C36H84O78S12 and molecular weight 2147.9255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol;sulfuric acid
Also Known As: alpha-C6(D)-12(SO2OH), alpha-Cyclohexadextrin dodecasulfate, alpha-Cyclodextrin, dodecakis(hydrogen sulfate), a.-C6(D)-12(SO2OH), .alpha.- Cyclohexadextrin dodecasulfate
Technical Specifications
| Molecular Formula | C36H84O78S12 |
| Molecular Weight | 2147.9255 g/mol |
| XLogP | -20.8884 |
| Topological Polar Surface Area (TPSA) | 1470.0 Ų |
| Hydrogen Bond Donors | 42 |
| Hydrogen Bond Acceptors | 78 |
| Rotatable Bonds | 6 |
| Exact Mass | 2147.9255 Da |
| Heavy Atoms | 126 |
| Complexity | 1330.0 |
| SMILES | C([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]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@H](O2)[C@@H]([C@H]7O)O)CO)CO)CO)CO)CO)O)O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O |
| InChIKey | PTUWKKPCRWRNGC-CCLRYOKDSA-N |
Chemical Property Profile of alpha-Cyclodextrin, dodecakis(hydrogen sulfate)
Property Insights of alpha-Cyclodextrin, dodecakis(hydrogen sulfate)
The XLogP value of -20.8884 indicates that alpha-Cyclodextrin, dodecakis(hydrogen sulfate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 1470.0 Ų indicates high polarity, suggesting alpha-Cyclodextrin, dodecakis(hydrogen sulfate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-Cyclodextrin, dodecakis(hydrogen sulfate) has 42 hydrogen bond donor(s) and 78 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of alpha-Cyclodextrin, dodecakis(hydrogen sulfate)?
The CAS number of alpha-Cyclodextrin, dodecakis(hydrogen sulfate) is 120825-95-8.
What is the molecular formula of alpha-Cyclodextrin, dodecakis(hydrogen sulfate)?
The molecular formula of alpha-Cyclodextrin, dodecakis(hydrogen sulfate) is C36H84O78S12.
What is the molecular weight of alpha-Cyclodextrin, dodecakis(hydrogen sulfate)?
The molecular weight of alpha-Cyclodextrin, dodecakis(hydrogen sulfate) is 2147.9255 g/mol.
Where can I buy alpha-Cyclodextrin, dodecakis(hydrogen sulfate)?
You can request a quote for alpha-Cyclodextrin, dodecakis(hydrogen sulfate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-Cyclodextrin, dodecakis(hydrogen sulfate)?
Yes, CoreyChem provides custom synthesis services for alpha-Cyclodextrin, dodecakis(hydrogen sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.