Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane
TL;DR: Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane (CAS 68130-52-9) is a chemical compound with molecular formula C30H62O9 and molecular weight 566.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decanoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanoic acid;octanoic acid
Also Known As: Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane, decanoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanoic acid;octanoic acid, Decanoic acid mixed esters with hexanoic acid octanoic acid and trimethylolpropane, Trimethylolpropane, caproic acid, caprylic acid, capric acid mixed esters, decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanoic acid; octanoic acid
| Molecular Formula | C30H62O9 |
|---|---|
| Molecular Weight | 566.44 g/mol |
| LogP | 6.6542 |
| Topological Polar Surface Area | 173.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 22 |
| Exact Mass | 566.4394 |
| Heavy Atoms | 39 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 68130-52-9 |
|---|---|
| SMILES | CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CCC(CO)(CO)CO |
| InChIKey | ZJZWENHCONOIDY-UHFFFAOYSA-N |
Product Overview
Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane (CAS 68130-52-9), with molecular formula C30H62O9 and molecular weight 566.44 g/mol. IUPAC: decanoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanoic acid;octanoic acid.
Chemical Property Profile of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane
Property Insights of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane
The XLogP value of 6.6542 indicates that Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 173.0 Ų indicates high polarity, suggesting Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane?
The CAS number of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane is 68130-52-9.
What is the molecular formula of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane?
The molecular formula of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane is C30H62O9.
What is the molecular weight of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane?
The molecular weight of Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane is 566.44 g/mol.
Where can I buy Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane?
You can request a quote for Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane?
Yes, KEHONG BIO provides custom synthesis services for Decanoic acid, mixed esters with hexanoic acid, octanoic acid and trimethylolpropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.