![Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester structure](/static/products/771/77145-66-5.png)
Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester
TL;DR: Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester (CAS 77145-66-5) is a chemical compound with molecular formula C61H114O6 and molecular weight 942.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl docosanoate
Also Known As: 1,2-Olein-3-Behenin, 1,2-Dioleoyl-3-behenoylglycerol, 2,3-Bis[[(Z)-octadec-9-enoyl]oxy]propyl docosanoate, 1,2-Dioleoyl-3-Docosanoyl-rac-glycerol, 1-O-Behenoyl-2-O,3-O-dioleoylglycerol
| Molecular Formula | C61H114O6 |
|---|---|
| Molecular Weight | 942.86 g/mol |
| LogP | 19.8815 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 55 |
| Exact Mass | 942.8615 |
| Heavy Atoms | 67 |
| Complexity | 1083.0525 |
Chemical Identifiers
| CAS Number | 77145-66-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC |
Product Overview
Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester (CAS 77145-66-5), with molecular formula C61H114O6 and molecular weight 942.86 g/mol. IUPAC: 2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl docosanoate.
Chemical Property Profile of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester
Property Insights of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester
The XLogP value of 19.8815 indicates that Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester 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 Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester. Following Lipinski's Rule of Five, Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester 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 Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester?
The CAS number of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester is 77145-66-5.
What is the molecular formula of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester?
The molecular formula of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester is C61H114O6.
What is the molecular weight of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester?
The molecular weight of Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester is 942.86 g/mol.
Where can I buy Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester?
You can request a quote for Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Docosanoic acid, 2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.