三庚酸甘油酯
TL;DR: 三庚酸甘油酯 (CAS 620-67-7) is a chemical compound with molecular formula C24H44O6 and molecular weight 428.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三庚酸甘油酯
2,3-di(heptanoyloxy)propyl heptanoate
Also Known As: Triheptanoin, Trioenanthoin, Trienanthoin, Triheptylin, Dojolvi
| Molecular Formula | C24H44O6 |
|---|---|
| Molecular Weight | 428.31 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 23 |
| Exact Mass | 428.31378 |
| Heavy Atoms | 30 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 620-67-7 |
|---|---|
| SMILES | CCCCCCC(=O)OCC(COC(=O)CCCCCC)OC(=O)CCCCCC |
| InChIKey | PJHKBYALYHRYSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三庚酸甘油酯 (CAS 620-67-7), with molecular formula C24H44O6 and molecular weight 428.31 g/mol. IUPAC: 2,3-di(heptanoyloxy)propyl heptanoate.
Chemical Property Profile of 三庚酸甘油酯
Property Insights of 三庚酸甘油酯
The XLogP value of 7.3 indicates that 三庚酸甘油酯 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 三庚酸甘油酯. Following Lipinski's Rule of Five, 三庚酸甘油酯 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 三庚酸甘油酯?
The CAS number of 三庚酸甘油酯 is 620-67-7.
What is the molecular formula of 三庚酸甘油酯?
The molecular formula of 三庚酸甘油酯 is C24H44O6.
What is the molecular weight of 三庚酸甘油酯?
The molecular weight of 三庚酸甘油酯 is 428.31 g/mol.
Where can I buy 三庚酸甘油酯?
You can request a quote for 三庚酸甘油酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三庚酸甘油酯?
Yes, KEHONG BIO provides custom synthesis services for 三庚酸甘油酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.