Dioctyl but-2-enedioate
TL;DR: Dioctyl but-2-enedioate (CAS 2915-53-9) is a chemical compound with molecular formula C20H36O4 and molecular weight 340.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dioctyl but-2-enedioate
Also Known As: Dioctyl maleate, Dioctyl fumarate, dioctyl but-2-enedioate, Bis(2-ethylhexyl)fumarate, Dioctyl (2e)-2-butenedioate
| Molecular Formula | C20H36O4 |
|---|---|
| Molecular Weight | 340.26 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 340.26135 |
| Heavy Atoms | 24 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 2915-53-9 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C=CC(=O)OCCCCCCCC |
| InChIKey | TVWTZAGVNBPXHU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dioctyl but-2-enedioate (CAS 2915-53-9), with molecular formula C20H36O4 and molecular weight 340.26 g/mol. IUPAC: dioctyl but-2-enedioate.
Chemical Property Profile of Dioctyl but-2-enedioate
Property Insights of Dioctyl but-2-enedioate
The XLogP value of 7.0 indicates that Dioctyl but-2-enedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dioctyl but-2-enedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dioctyl but-2-enedioate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dioctyl but-2-enedioate?
The CAS number of Dioctyl but-2-enedioate is 2915-53-9.
What is the molecular formula of Dioctyl but-2-enedioate?
The molecular formula of Dioctyl but-2-enedioate is C20H36O4.
What is the molecular weight of Dioctyl but-2-enedioate?
The molecular weight of Dioctyl but-2-enedioate is 340.26 g/mol.
Where can I buy Dioctyl but-2-enedioate?
You can request a quote for Dioctyl but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dioctyl but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for Dioctyl but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.