1,3-Dioctadecenoyl-2-hexadecylglycerol
TL;DR: 1,3-Dioctadecenoyl-2-hexadecylglycerol (CAS 78610-63-6) is a chemical compound with molecular formula C55H104O5 and molecular weight 844.79 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hexadecoxy-3-[(E)-octadec-2-enoyl]oxypropyl] (E)-octadec-2-enoate
Also Known As: 1,3-Dioctadecenoyl-2-hexadecylglycerol, [2-hexadecoxy-3-[(E)-octadec-2-enoyl]oxypropyl] (E)-octadec-2-enoate, Octadecenoic acid, 2-(hexadecyloxy)-1,3-propanediyl ester, RefChem:72755
| Molecular Formula | C55H104O5 |
|---|---|
| Molecular Weight | 844.79 g/mol |
| LogP | 18.0143 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 50 |
| Exact Mass | 844.7884 |
| Heavy Atoms | 60 |
| Complexity | 856.5434 |
Chemical Identifiers
| CAS Number | 78610-63-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC(COC(=O)/C=C/CCCCCCCCCCCCCCC)COC(=O)/C=C/CCCCCCCCCCCCCCC |
Product Overview
1,3-Dioctadecenoyl-2-hexadecylglycerol (CAS 78610-63-6), with molecular formula C55H104O5 and molecular weight 844.79 g/mol. IUPAC: [2-hexadecoxy-3-[(E)-octadec-2-enoyl]oxypropyl] (E)-octadec-2-enoate.
Chemical Property Profile of 1,3-Dioctadecenoyl-2-hexadecylglycerol
Property Insights of 1,3-Dioctadecenoyl-2-hexadecylglycerol
The XLogP value of 18.0143 indicates that 1,3-Dioctadecenoyl-2-hexadecylglycerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dioctadecenoyl-2-hexadecylglycerol. Following Lipinski's Rule of Five, 1,3-Dioctadecenoyl-2-hexadecylglycerol 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 1,3-Dioctadecenoyl-2-hexadecylglycerol?
The CAS number of 1,3-Dioctadecenoyl-2-hexadecylglycerol is 78610-63-6.
What is the molecular formula of 1,3-Dioctadecenoyl-2-hexadecylglycerol?
The molecular formula of 1,3-Dioctadecenoyl-2-hexadecylglycerol is C55H104O5.
What is the molecular weight of 1,3-Dioctadecenoyl-2-hexadecylglycerol?
The molecular weight of 1,3-Dioctadecenoyl-2-hexadecylglycerol is 844.79 g/mol.
Where can I buy 1,3-Dioctadecenoyl-2-hexadecylglycerol?
You can request a quote for 1,3-Dioctadecenoyl-2-hexadecylglycerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioctadecenoyl-2-hexadecylglycerol?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioctadecenoyl-2-hexadecylglycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.