Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol
TL;DR: Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol (CAS 71010-84-9) is a chemical compound with molecular formula C30H62O8 and molecular weight 550.44 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;octadecanoic acid
Also Known As: Pentaerythritol mixed stearates and heptanoates, Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol, 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; stearic acid, Stearic acid esters,heptanoic acid pentaerythritol complex, Tetrapropenylsuccinic acid, mono(ethoxylated (C12-C15) alkyl alcohol) ester
| Molecular Formula | C30H62O8 |
|---|---|
| Molecular Weight | 550.44 g/mol |
| LogP | 6.32 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Exact Mass | 550.44446 |
| Heavy Atoms | 38 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 71010-84-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)CO)O |
| InChIKey | HEQNLZZBNGTGMN-UHFFFAOYSA-N |
Product Overview
Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol (CAS 71010-84-9), with molecular formula C30H62O8 and molecular weight 550.44 g/mol. IUPAC: 2,2-bis(hydroxymethyl)propane-1,3-diol;heptanoic acid;octadecanoic acid.
Chemical Property Profile of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol
Property Insights of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol
The XLogP value of 6.32 indicates that Octadecanoic 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 Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Octadecanoic 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 Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The CAS number of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol is 71010-84-9.
What is the molecular formula of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The molecular formula of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol is C30H62O8.
What is the molecular weight of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
The molecular weight of Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol is 550.44 g/mol.
Where can I buy Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
You can request a quote for Octadecanoic 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 Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, mixed esters with heptanoic acid and pentaerythritol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.