Tricaproin
TL;DR: Tricaproin (CAS 621-70-5) is a chemical compound with molecular formula C21H38O6 and molecular weight 386.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-di(hexanoyloxy)propyl hexanoate
Also Known As: Trihexanoin, Glycerol trihexanoate, Tricapronin, Tricaproylglycerol, Caproic triglyceride
| Molecular Formula | C21H38O6 |
|---|---|
| Molecular Weight | 386.27 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 20 |
| Exact Mass | 386.26685 |
| Heavy Atoms | 27 |
| Complexity | 381.0 |
| Melting Point | -25 °C |
| Boiling Point | 244.00 °C. @ 28.00 mm Hg |
| Solubility | 0.00045 mg/mL at 37 °C |
Chemical Identifiers
| CAS Number | 621-70-5 |
|---|---|
| SMILES | CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC |
| InChIKey | MAYCICSNZYXLHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tricaproin (CAS 621-70-5), with molecular formula C21H38O6 and molecular weight 386.27 g/mol. IUPAC: 2,3-di(hexanoyloxy)propyl hexanoate.
Chemical Property Profile of Tricaproin
Property Insights of Tricaproin
The XLogP value of 5.7 indicates that Tricaproin 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 Tricaproin. Following Lipinski's Rule of Five, Tricaproin 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 Tricaproin?
The CAS number of Tricaproin is 621-70-5.
What is the molecular formula of Tricaproin?
The molecular formula of Tricaproin is C21H38O6.
What is the molecular weight of Tricaproin?
The molecular weight of Tricaproin is 386.27 g/mol.
Where can I buy Tricaproin?
You can request a quote for Tricaproin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricaproin?
Yes, KEHONG BIO provides custom synthesis services for Tricaproin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.