D-Glucitol, monooctadecanoate
TL;DR: D-Glucitol, monooctadecanoate (CAS 3231-90-1) is a chemical compound with molecular formula C24H48O7 and molecular weight 448.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl] octadecanoate
Also Known As: D-Glucitol monostearate, D-glucitolmonostearate, D-Glucitol, monooctadecanoate, 1-o-stearoyl-d-glucitol, Glucitol, stearate, D-
| Molecular Formula | C24H48O7 |
|---|---|
| Molecular Weight | 448.34 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 23 |
| Exact Mass | 448.34 |
| Heavy Atoms | 31 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 3231-90-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O |
| InChIKey | KEFRSFBGIAUBNZ-CBJLPSGESA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
D-Glucitol, monooctadecanoate (CAS 3231-90-1), with molecular formula C24H48O7 and molecular weight 448.34 g/mol. IUPAC: [(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl] octadecanoate.
Chemical Property Profile of D-Glucitol, monooctadecanoate
Property Insights of D-Glucitol, monooctadecanoate
The XLogP value of 5.4 indicates that D-Glucitol, monooctadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for D-Glucitol, monooctadecanoate. Following Lipinski's Rule of Five, D-Glucitol, monooctadecanoate has 5 hydrogen bond donor(s) and 7 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, monooctadecanoate?
The CAS number of D-Glucitol, monooctadecanoate is 3231-90-1.
What is the molecular formula of D-Glucitol, monooctadecanoate?
The molecular formula of D-Glucitol, monooctadecanoate is C24H48O7.
What is the molecular weight of D-Glucitol, monooctadecanoate?
The molecular weight of D-Glucitol, monooctadecanoate is 448.34 g/mol.
Where can I buy D-Glucitol, monooctadecanoate?
You can request a quote for D-Glucitol, monooctadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-Glucitol, monooctadecanoate?
Yes, KEHONG BIO provides custom synthesis services for D-Glucitol, monooctadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.