Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]
TL;DR: Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] (CAS 106-80-9) is a chemical compound with molecular formula C63H110O15 and molecular weight 1106.78 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis[8-[3-(2-acetyloxyoctyl)oxiran-2-yl]octanoyloxy]propyl 8-[3-(2-acetyloxyoctyl)oxiran-2-yl]octanoate
Also Known As: Estynox, EINECS 203-433-5, Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate], Propane-1,2,3-triyl tris(3-(2-acetoxyoctyl)oxiran-2-octanoate), 2-Amino-4,5-dihydro-1,3-thiazol-4-one hydrochloride
| Molecular Formula | C63H110O15 |
|---|---|
| Molecular Weight | 1106.78 g/mol |
| LogP | 14.3555 |
| Topological Polar Surface Area | 195.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 53 |
| Exact Mass | 1106.7844 |
| Heavy Atoms | 78 |
| Complexity | 1544.141 |
Chemical Identifiers
| CAS Number | 106-80-9 |
|---|---|
| SMILES | CCCCCCC(CC1C(O1)CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC2C(O2)CC(CCCCCC)OC(=O)C)OC(=O)CCCCCCCC3C(O3)CC(CCCCCC)OC(=O)C)OC(=O)C |
Product Overview
Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] (CAS 106-80-9), with molecular formula C63H110O15 and molecular weight 1106.78 g/mol. IUPAC: 2,3-bis[8-[3-(2-acetyloxyoctyl)oxiran-2-yl]octanoyloxy]propyl 8-[3-(2-acetyloxyoctyl)oxiran-2-yl]octanoate.
Chemical Property Profile of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]
Property Insights of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]
The XLogP value of 14.3555 indicates that Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 195.39 Ų indicates high polarity, suggesting Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] has 0 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]?
The CAS number of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] is 106-80-9.
What is the molecular formula of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]?
The molecular formula of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] is C63H110O15.
What is the molecular weight of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]?
The molecular weight of Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] is 1106.78 g/mol.
Where can I buy Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]?
You can request a quote for Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate]?
Yes, KEHONG BIO provides custom synthesis services for Propane-1,2,3-triyl tris[3-(2-acetoxyoctyl)oxiran-2-octanoate] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.