Diethyl 2-octadecanoylpropanedioate
TL;DR: Diethyl 2-octadecanoylpropanedioate (CAS 24514-82-7) is a chemical compound with molecular formula C25H46O5 and molecular weight 426.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-octadecanoylpropanedioate
Also Known As: diethyl 2-octadecanoylpropanedioate, Diethyl octadecanoylpropanedioate, Octadecanoyl-malonsaeure-diaethylester, Propanedioic acid,2-(1-oxooctadecyl)-, 1,3-diethyl ester
| Molecular Formula | C25H46O5 |
|---|---|
| Molecular Weight | 426.33 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 23 |
| Exact Mass | 426.33453 |
| Heavy Atoms | 30 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 24514-82-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)C(C(=O)OCC)C(=O)OCC |
| InChIKey | GPDXGWPSHSECAO-UHFFFAOYSA-N |
Product Overview
Diethyl 2-octadecanoylpropanedioate (CAS 24514-82-7), with molecular formula C25H46O5 and molecular weight 426.33 g/mol. IUPAC: diethyl 2-octadecanoylpropanedioate.
Chemical Property Profile of Diethyl 2-octadecanoylpropanedioate
Property Insights of Diethyl 2-octadecanoylpropanedioate
The XLogP value of 9.2 indicates that Diethyl 2-octadecanoylpropanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-octadecanoylpropanedioate. Following Lipinski's Rule of Five, Diethyl 2-octadecanoylpropanedioate 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 Diethyl 2-octadecanoylpropanedioate?
The CAS number of Diethyl 2-octadecanoylpropanedioate is 24514-82-7.
What is the molecular formula of Diethyl 2-octadecanoylpropanedioate?
The molecular formula of Diethyl 2-octadecanoylpropanedioate is C25H46O5.
What is the molecular weight of Diethyl 2-octadecanoylpropanedioate?
The molecular weight of Diethyl 2-octadecanoylpropanedioate is 426.33 g/mol.
Where can I buy Diethyl 2-octadecanoylpropanedioate?
You can request a quote for Diethyl 2-octadecanoylpropanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-octadecanoylpropanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-octadecanoylpropanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.