Trinonanoin
TL;DR: Trinonanoin (CAS 126-53-4) is a chemical compound with molecular formula C30H56O6 and molecular weight 512.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-di(nonanoyloxy)propyl nonanoate
Also Known As: Tripelargonin, Trinonanoin, Tripelargoin, Trinonanoate, Trinonylin
| Molecular Formula | C30H56O6 |
|---|---|
| Molecular Weight | 512.41 g/mol |
| LogP | 10.6 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 29 |
| Exact Mass | 512.4077 |
| Heavy Atoms | 36 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 126-53-4 |
|---|---|
| SMILES | CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC)OC(=O)CCCCCCCC |
| InChIKey | YRIMSXJXBHUHJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trinonanoin (CAS 126-53-4), with molecular formula C30H56O6 and molecular weight 512.41 g/mol. IUPAC: 2,3-di(nonanoyloxy)propyl nonanoate.
Chemical Property Profile of Trinonanoin
Property Insights of Trinonanoin
The XLogP value of 10.6 indicates that Trinonanoin 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 Trinonanoin. Following Lipinski's Rule of Five, Trinonanoin 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 Trinonanoin?
The CAS number of Trinonanoin is 126-53-4.
What is the molecular formula of Trinonanoin?
The molecular formula of Trinonanoin is C30H56O6.
What is the molecular weight of Trinonanoin?
The molecular weight of Trinonanoin is 512.41 g/mol.
Where can I buy Trinonanoin?
You can request a quote for Trinonanoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trinonanoin?
Yes, KEHONG BIO provides custom synthesis services for Trinonanoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.