9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester
TL;DR: 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester (CAS 18266-27-8) is a chemical compound with molecular formula C39H74O5 and molecular weight 622.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-3-[(E)-octadec-9-enoyl]oxypropyl] octadecanoate
Also Known As: 3-Stearo-1-olein, 1-Stearoyl-3-Oleoyl-rac-glycerol, 2-Hydroxy-3-(stearoyloxy)propyl (9E)-9-octadecenoate, 2-Hydroxy-3-(stearoyloxy)propyl (9E)-9-octadecenoate #, [2-hydroxy-3-[(E)-octadec-9-enoyl]oxypropyl] octadecanoate
| Molecular Formula | C39H74O5 |
|---|---|
| Molecular Weight | 622.55 g/mol |
| LogP | 11.7327 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 35 |
| Exact Mass | 622.55365 |
| Heavy Atoms | 44 |
| Complexity | 632.0025 |
Chemical Identifiers
| CAS Number | 18266-27-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)O |
Product Overview
9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester (CAS 18266-27-8), with molecular formula C39H74O5 and molecular weight 622.55 g/mol. IUPAC: [2-hydroxy-3-[(E)-octadec-9-enoyl]oxypropyl] octadecanoate.
Chemical Property Profile of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester
Property Insights of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester
The XLogP value of 11.7327 indicates that 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester. Following Lipinski's Rule of Five, 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester has 1 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 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester?
The CAS number of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester is 18266-27-8.
What is the molecular formula of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester?
The molecular formula of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester is C39H74O5.
What is the molecular weight of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester?
The molecular weight of 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester is 622.55 g/mol.
Where can I buy 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester?
You can request a quote for 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)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 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 9-Octadecenoic acid (Z)-, 2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.