Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol
TL;DR: Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol (CAS 70693-46-8) is a chemical compound with molecular formula C23H48O8 and molecular weight 452.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(hydroxymethyl)propane-1,3-diol;heptanoic acid;undecanoic acid
Also Known As: Pentaerythritol, enanthylic acid, undecylic esters, Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol, Undecanoic acid mixed esters with heptanoic acid and pentaerythritol, 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; undecanoic acid, 2,2-Bis(hydroxymethyl)propane-1,3-diol;heptanoic acid;undecanoic acid
| Molecular Formula | C23H48O8 |
|---|---|
| Molecular Weight | 452.33 g/mol |
| LogP | 3.59 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 18 |
| Exact Mass | 452.33493 |
| Heavy Atoms | 31 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 70693-46-8 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)CO)O |
| InChIKey | CXVSBXLIWVNRJT-UHFFFAOYSA-N |
Product Overview
Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol (CAS 70693-46-8), with molecular formula C23H48O8 and molecular weight 452.33 g/mol. IUPAC: 2,2-bis(hydroxymethyl)propane-1,3-diol;heptanoic acid;undecanoic acid.
Chemical Property Profile of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol
Property Insights of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol
The XLogP value of 3.59 indicates that Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The CAS number of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol is 70693-46-8.
What is the molecular formula of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The molecular formula of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol is C23H48O8.
What is the molecular weight of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The molecular weight of Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol is 452.33 g/mol.
Where can I buy Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
You can request a quote for Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
Yes, KEHONG BIO provides custom synthesis services for Undecanoic acid, mixed esters with heptanoic acid and pentaerythritol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.