2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate
TL;DR: 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate (CAS 3331-41-7) is a chemical compound with molecular formula C55H102O6 and molecular weight 858.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hexadecanoyloxy-3-octadec-9-enoyloxypropyl) octadec-9-enoate
Also Known As: 1,3-Dioleoyl-2-palmitoylglycerol, 1,3-Dioleo-2-palmitin, 2-Palmito-1,3-diolein, 1,3-Di(cis-9-octadecenoyl)-2-hexadecanoylglycerol, 2-(Hexadecanoyloxy)propane-1,3-diyl dioctadec-9-enoate
| Molecular Formula | C55H102O6 |
|---|---|
| Molecular Weight | 858.77 g/mol |
| LogP | 17.5409 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 49 |
| Exact Mass | 858.76764 |
| Heavy Atoms | 61 |
| Complexity | 932.8132 |
Chemical Identifiers
| CAS Number | 3331-41-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC |
Product Overview
2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate (CAS 3331-41-7), with molecular formula C55H102O6 and molecular weight 858.77 g/mol. IUPAC: (2-hexadecanoyloxy-3-octadec-9-enoyloxypropyl) octadec-9-enoate.
Chemical Property Profile of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate
Property Insights of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate
The XLogP value of 17.5409 indicates that 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate 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 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate. Following Lipinski's Rule of Five, 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate 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 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate?
The CAS number of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate is 3331-41-7.
What is the molecular formula of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate?
The molecular formula of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate is C55H102O6.
What is the molecular weight of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate?
The molecular weight of 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate is 858.77 g/mol.
Where can I buy 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate?
You can request a quote for 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hexadecanoyloxy)-3-(octadec-9-enoyloxy)propyl octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.