2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate
TL;DR: 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate (CAS 1867-91-0) is a chemical compound with molecular formula C53H100O6 and molecular weight 832.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate
Also Known As: a,b-Dipalmitoolein, 1,2-Palmitin-3-Elaidin, 1,2-Palmitate-3-elaidate, 1,2-Palmitin-3-Olein, 2,3-Dipalmito-1-olein
| Molecular Formula | C53H100O6 |
|---|---|
| Molecular Weight | 832.75 g/mol |
| LogP | 16.9847 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 48 |
| Exact Mass | 832.752 |
| Heavy Atoms | 59 |
| Complexity | 915.70074 |
Chemical Identifiers
| CAS Number | 1867-91-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
Product Overview
2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate (CAS 1867-91-0), with molecular formula C53H100O6 and molecular weight 832.75 g/mol. IUPAC: 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate.
Chemical Property Profile of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate
Property Insights of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate
The XLogP value of 16.9847 indicates that 2,3-di(hexadecanoyloxy)propyl (E)-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 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate. Following Lipinski's Rule of Five, 2,3-di(hexadecanoyloxy)propyl (E)-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 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate?
The CAS number of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate is 1867-91-0.
What is the molecular formula of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate?
The molecular formula of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate is C53H100O6.
What is the molecular weight of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate?
The molecular weight of 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate is 832.75 g/mol.
Where can I buy 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate?
You can request a quote for 2,3-di(hexadecanoyloxy)propyl (E)-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 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.