Glyceryl trivalproate
TL;DR: Glyceryl trivalproate (CAS 1736-90-9) is a chemical compound with molecular formula C27H50O6 and molecular weight 470.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(2-propylpentanoyloxy)propyl 2-propylpentanoate
Also Known As: Glyceryl trivalproate, propane-1,2,3-triyl tris(2-propylpentanoate), 2,3-bis(2-propylpentanoyloxy)propyl 2-propylpentanoate, Pentanoic acid,2-propyl-, 1,2,3-propanetriyl ester (9CI), Tris(2-propylpentanoic acid)1,2,3-propanetriyl ester
| Molecular Formula | C27H50O6 |
|---|---|
| Molecular Weight | 470.36 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 23 |
| Exact Mass | 470.36075 |
| Heavy Atoms | 33 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 1736-90-9 |
|---|---|
| SMILES | CCCC(CCC)C(=O)OCC(COC(=O)C(CCC)CCC)OC(=O)C(CCC)CCC |
| InChIKey | GNEIIXKXKQGWGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glyceryl trivalproate (CAS 1736-90-9), with molecular formula C27H50O6 and molecular weight 470.36 g/mol. IUPAC: 2,3-bis(2-propylpentanoyloxy)propyl 2-propylpentanoate.
Chemical Property Profile of Glyceryl trivalproate
Property Insights of Glyceryl trivalproate
The XLogP value of 8.5 indicates that Glyceryl trivalproate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Glyceryl trivalproate. Following Lipinski's Rule of Five, Glyceryl trivalproate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glyceryl trivalproate?
The CAS number of Glyceryl trivalproate is 1736-90-9.
What is the molecular formula of Glyceryl trivalproate?
The molecular formula of Glyceryl trivalproate is C27H50O6.
What is the molecular weight of Glyceryl trivalproate?
The molecular weight of Glyceryl trivalproate is 470.36 g/mol.
Where can I buy Glyceryl trivalproate?
You can request a quote for Glyceryl trivalproate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glyceryl trivalproate?
Yes, KEHONG BIO provides custom synthesis services for Glyceryl trivalproate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.