Glyceryl 1,3-distearate
TL;DR: Glyceryl 1,3-distearate (CAS 504-40-5) is a chemical compound with molecular formula C39H76O5 and molecular weight 624.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-3-octadecanoyloxypropyl) octadecanoate
Also Known As: Glyceryl 1,3-distearate, 1,3-Distearin, 1,3-Distearoylglycerol, Distearin, 1,3-Distearoylglycerin
| Molecular Formula | C39H76O5 |
|---|---|
| Molecular Weight | 624.57 g/mol |
| LogP | 16.2 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 38 |
| Exact Mass | 624.5693 |
| Heavy Atoms | 44 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 504-40-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)O |
| InChIKey | IZHVBANLECCAGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glyceryl 1,3-distearate (CAS 504-40-5), with molecular formula C39H76O5 and molecular weight 624.57 g/mol. IUPAC: (2-hydroxy-3-octadecanoyloxypropyl) octadecanoate.
Chemical Property Profile of Glyceryl 1,3-distearate
Property Insights of Glyceryl 1,3-distearate
The XLogP value of 16.2 indicates that Glyceryl 1,3-distearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Glyceryl 1,3-distearate. Following Lipinski's Rule of Five, Glyceryl 1,3-distearate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glyceryl 1,3-distearate?
The CAS number of Glyceryl 1,3-distearate is 504-40-5.
What is the molecular formula of Glyceryl 1,3-distearate?
The molecular formula of Glyceryl 1,3-distearate is C39H76O5.
What is the molecular weight of Glyceryl 1,3-distearate?
The molecular weight of Glyceryl 1,3-distearate is 624.57 g/mol.
Where can I buy Glyceryl 1,3-distearate?
You can request a quote for Glyceryl 1,3-distearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glyceryl 1,3-distearate?
Yes, KEHONG BIO provides custom synthesis services for Glyceryl 1,3-distearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.