D-Glucitol 1,6-didocosanoate
TL;DR: D-Glucitol 1,6-didocosanoate (CAS 54390-90-8) is a chemical compound with molecular formula C50H98O8 and molecular weight 826.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R,5S)-6-docosanoyloxy-2,3,4,5-tetrahydroxyhexyl] docosanoate
Also Known As: D-Glucitol 1,6-didocosanoate, EINECS 259-139-2, 1,6-Di-O-docosanoyl-D-glucitol, tetraazanium,dioxido-oxo-phosphonato-, E5-phosphane
| Molecular Formula | C50H98O8 |
|---|---|
| Molecular Weight | 826.73 g/mol |
| LogP | 13.1602 |
| Topological Polar Surface Area | 133.52 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 47 |
| Exact Mass | 826.7262 |
| Heavy Atoms | 58 |
| Complexity | 785.465 |
Chemical Identifiers
| CAS Number | 54390-90-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H]([C@H]([C@@H]([C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)O)O)O)O |
Product Overview
D-Glucitol 1,6-didocosanoate (CAS 54390-90-8), with molecular formula C50H98O8 and molecular weight 826.73 g/mol. IUPAC: [(2R,3R,4R,5S)-6-docosanoyloxy-2,3,4,5-tetrahydroxyhexyl] docosanoate.
Chemical Property Profile of D-Glucitol 1,6-didocosanoate
Property Insights of D-Glucitol 1,6-didocosanoate
The XLogP value of 13.1602 indicates that D-Glucitol 1,6-didocosanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.52 Ų falls within the moderate polarity range, balancing permeability and solubility for D-Glucitol 1,6-didocosanoate. Following Lipinski's Rule of Five, D-Glucitol 1,6-didocosanoate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-Glucitol 1,6-didocosanoate?
The CAS number of D-Glucitol 1,6-didocosanoate is 54390-90-8.
What is the molecular formula of D-Glucitol 1,6-didocosanoate?
The molecular formula of D-Glucitol 1,6-didocosanoate is C50H98O8.
What is the molecular weight of D-Glucitol 1,6-didocosanoate?
The molecular weight of D-Glucitol 1,6-didocosanoate is 826.73 g/mol.
Where can I buy D-Glucitol 1,6-didocosanoate?
You can request a quote for D-Glucitol 1,6-didocosanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-Glucitol 1,6-didocosanoate?
Yes, KEHONG BIO provides custom synthesis services for D-Glucitol 1,6-didocosanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.