6-Bromo-6-deoxy-a-cyclodextrin
TL;DR: 6-Bromo-6-deoxy-a-cyclodextrin (CAS 53784-82-0) is a chemical compound with molecular formula C36H54Br6O24 and molecular weight 1343.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3S,6S,8S,11S,13S,16S,18S,21S,23S,26S,28S)-5,10,15,20,25,30-hexakis(bromomethyl)-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
Also Known As: 6-Bromo-6-deoxy-a-cyclodextrin, 6-Bromo-6-deoxy-alpha-cyclodextrin, Hexakis-(6-bromo-6-deoxy)-a-cyclodextrin, hexakis(6-bromo-6-deoxy)cyclomaltohexaose, hexakis-(6-bromo-6-deoxy)-
| Molecular Formula | C36H54Br6O24 |
|---|---|
| Molecular Weight | 1343.81 g/mol |
| LogP | -4.6392 |
| Topological Polar Surface Area | 353.52 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 6 |
| Exact Mass | 1343.8105 |
| Heavy Atoms | 66 |
| Complexity | 1255.1436 |
Chemical Identifiers
| CAS Number | 53784-82-0 |
|---|---|
| SMILES | C(C1[C@@H]2C(C([C@H](O1)O[C@@H]3C(O[C@@H](C(C3O)O)O[C@@H]4C(O[C@@H](C(C4O)O)O[C@@H]5C(O[C@@H](C(C5O)O)O[C@@H]6C(O[C@@H](C(C6O)O)O[C@@H]7C(O[C@H](O2)C(C7O)O)CBr)CBr)CBr)CBr)CBr)O)O)Br |
Product Overview
6-Bromo-6-deoxy-a-cyclodextrin (CAS 53784-82-0), with molecular formula C36H54Br6O24 and molecular weight 1343.81 g/mol. IUPAC: (1S,3S,6S,8S,11S,13S,16S,18S,21S,23S,26S,28S)-5,10,15,20,25,30-hexakis(bromomethyl)-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.
Chemical Property Profile of 6-Bromo-6-deoxy-a-cyclodextrin
Property Insights of 6-Bromo-6-deoxy-a-cyclodextrin
The XLogP value of -4.6392 indicates that 6-Bromo-6-deoxy-a-cyclodextrin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 353.52 Ų indicates high polarity, suggesting 6-Bromo-6-deoxy-a-cyclodextrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Bromo-6-deoxy-a-cyclodextrin has 12 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Bromo-6-deoxy-a-cyclodextrin?
The CAS number of 6-Bromo-6-deoxy-a-cyclodextrin is 53784-82-0.
What is the molecular formula of 6-Bromo-6-deoxy-a-cyclodextrin?
The molecular formula of 6-Bromo-6-deoxy-a-cyclodextrin is C36H54Br6O24.
What is the molecular weight of 6-Bromo-6-deoxy-a-cyclodextrin?
The molecular weight of 6-Bromo-6-deoxy-a-cyclodextrin is 1343.81 g/mol.
Where can I buy 6-Bromo-6-deoxy-a-cyclodextrin?
You can request a quote for 6-Bromo-6-deoxy-a-cyclodextrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-6-deoxy-a-cyclodextrin?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-6-deoxy-a-cyclodextrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.