3,6-Anhydro-1-O-octadecanoylhexitol
TL;DR: 3,6-Anhydro-1-O-octadecanoylhexitol (CAS 96094-21-2) is a chemical compound with molecular formula C24H46O6 and molecular weight 430.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl] octadecanoate
Also Known As: Sorbitan stearate, Span 60, SORBITAN MONOSTEARATE, Glycomul S, Liposorb S
| Molecular Formula | C24H46O6 |
|---|---|
| Molecular Weight | 430.33 g/mol |
| LogP | 4.2726 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Exact Mass | 430.32944 |
| Heavy Atoms | 30 |
| Complexity | 416.50034 |
Chemical Identifiers
| CAS Number | 96094-21-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)O)O)O |
Product Overview
3,6-Anhydro-1-O-octadecanoylhexitol (CAS 96094-21-2), with molecular formula C24H46O6 and molecular weight 430.33 g/mol. IUPAC: [2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl] octadecanoate.
Chemical Property Profile of 3,6-Anhydro-1-O-octadecanoylhexitol
Property Insights of 3,6-Anhydro-1-O-octadecanoylhexitol
The XLogP value of 4.2726 indicates that 3,6-Anhydro-1-O-octadecanoylhexitol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-Anhydro-1-O-octadecanoylhexitol. Following Lipinski's Rule of Five, 3,6-Anhydro-1-O-octadecanoylhexitol has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Anhydro-1-O-octadecanoylhexitol?
The CAS number of 3,6-Anhydro-1-O-octadecanoylhexitol is 96094-21-2.
What is the molecular formula of 3,6-Anhydro-1-O-octadecanoylhexitol?
The molecular formula of 3,6-Anhydro-1-O-octadecanoylhexitol is C24H46O6.
What is the molecular weight of 3,6-Anhydro-1-O-octadecanoylhexitol?
The molecular weight of 3,6-Anhydro-1-O-octadecanoylhexitol is 430.33 g/mol.
Where can I buy 3,6-Anhydro-1-O-octadecanoylhexitol?
You can request a quote for 3,6-Anhydro-1-O-octadecanoylhexitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Anhydro-1-O-octadecanoylhexitol?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Anhydro-1-O-octadecanoylhexitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.