Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester
TL;DR: Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester (CAS 68966-76-7) is a chemical compound with molecular formula C54H90O5 and molecular weight 818.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(18-phenyloctadecanoyloxy)propoxy]propan-2-yl 18-phenyloctadecanoate
Also Known As: Dipropylene glycol bis(phenylstearate), Octadecanoic acid, phenyl-, oxybis(methyl-2,1-ethanediyl) ester, Oxydi(propane-1,2-diyl) bis(18-phenyloctadecanoate), Oxybis(methyl-2,1-ethanediyl) bis(phenyloctadecanoate), Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester
| Molecular Formula | C54H90O5 |
|---|---|
| Molecular Weight | 818.68 g/mol |
| LogP | 20.4 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 44 |
| Exact Mass | 818.67883 |
| Heavy Atoms | 59 |
| Complexity | 836.0 |
Chemical Identifiers
| CAS Number | 68966-76-7 |
|---|---|
| SMILES | CC(COCC(C)OC(=O)CCCCCCCCCCCCCCCCCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCCCCCCCC2=CC=CC=C2 |
| InChIKey | PPLXRTHJBXOAMX-UHFFFAOYSA-N |
Product Overview
Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester (CAS 68966-76-7), with molecular formula C54H90O5 and molecular weight 818.68 g/mol. IUPAC: 1-[2-(18-phenyloctadecanoyloxy)propoxy]propan-2-yl 18-phenyloctadecanoate.
Chemical Property Profile of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester
Property Insights of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester
The XLogP value of 20.4 indicates that Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester. Following Lipinski's Rule of Five, Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester has 0 hydrogen bond donor(s) and 5 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, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester?
The CAS number of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester is 68966-76-7.
What is the molecular formula of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester?
The molecular formula of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester is C54H90O5.
What is the molecular weight of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester?
The molecular weight of Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester is 818.68 g/mol.
Where can I buy Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester?
You can request a quote for Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, phenyl-, 1,1'-(oxybis(methyl-2,1-ethanediyl)) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.