2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate
TL;DR: 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate (CAS 15834-06-7) is a chemical compound with molecular formula C31H58O6 and molecular weight 526.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(heptanoyloxymethyl)-2-(nonanoyloxymethyl)butyl] nonanoate
Also Known As: [2-(heptanoyloxymethyl)-2-(nonanoyloxymethyl)butyl] nonanoate|2-[(heptanoyloxy)methyl]-2-[(nonanoyloxy)methyl]butyl nonanoate|2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate|2-ETHYL-2-[[(1-OXOHEPTYL)OXY]METHYL]PROPANE-1,3-DIYL DINONAN-1-OATE|Bis(nonanoic acid)2-ethyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester|Nonanoic acid,2-ethyl-2-[[(1-oxoheptyl)oxy]methyl]-1,3-propanediyl ester (9CI)|EINECS 239-939-8|WISHAYXBCWYEPX-UHFFFAOYSA-N
| Molecular Formula | C31H58O6 |
|---|---|
| Molecular Weight | 526.42 g/mol |
| LogP | 10.4 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 29 |
| Exact Mass | 526.42334 |
| Heavy Atoms | 37 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 15834-06-7 |
|---|---|
| SMILES | CCCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCC)COC(=O)CCCCCCCC |
| InChIKey | WISHAYXBCWYEPX-UHFFFAOYSA-N |
Product Overview
2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate (CAS 15834-06-7), with molecular formula C31H58O6 and molecular weight 526.42 g/mol. IUPAC: [2-(heptanoyloxymethyl)-2-(nonanoyloxymethyl)butyl] nonanoate.
Chemical Property Profile of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate
Property Insights of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate
The XLogP value of 10.4 indicates that 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate 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-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate. Following Lipinski's Rule of Five, 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate 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-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate?
The CAS number of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate is 15834-06-7.
What is the molecular formula of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate?
The molecular formula of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate is C31H58O6.
What is the molecular weight of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate?
The molecular weight of 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate is 526.42 g/mol.
Where can I buy 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate?
You can request a quote for 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-2-(((1-oxoheptyl)oxy)methyl)propane-1,3-diyl dinonan-1-oate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.