Dioctyl 2-hydroxybutanedioate
TL;DR: Dioctyl 2-hydroxybutanedioate (CAS 15763-02-7) is a chemical compound with molecular formula C20H38O5 and molecular weight 358.2719 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dioctyl 2-hydroxybutanedioate
Also Known As: dioctyl malate, Dioctyl 2-hydroxysuccinate, Dioctyl 2-hydroxybutanedioate, 2-Hydroxysuccinic acid dioctyl ester, 1,4-DIOCTYL 2-HYDROXYBUTANEDIOATE
Technical Specifications
| Molecular Formula | C20H38O5 |
| Molecular Weight | 358.2719 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 19 |
| Exact Mass | 358.2719 Da |
| Heavy Atoms | 25 |
| Complexity | 330.0 |
| SMILES | CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)O |
| InChIKey | CNHQWLUGXFIDAT-UHFFFAOYSA-N |
Chemical Property Profile of Dioctyl 2-hydroxybutanedioate
Property Insights of Dioctyl 2-hydroxybutanedioate
The XLogP value of 6.2 indicates that Dioctyl 2-hydroxybutanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dioctyl 2-hydroxybutanedioate. Following Lipinski's Rule of Five, Dioctyl 2-hydroxybutanedioate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dioctyl 2-hydroxybutanedioate?
The CAS number of Dioctyl 2-hydroxybutanedioate is 15763-02-7.
What is the molecular formula of Dioctyl 2-hydroxybutanedioate?
The molecular formula of Dioctyl 2-hydroxybutanedioate is C20H38O5.
What is the molecular weight of Dioctyl 2-hydroxybutanedioate?
The molecular weight of Dioctyl 2-hydroxybutanedioate is 358.2719 g/mol.
Where can I buy Dioctyl 2-hydroxybutanedioate?
You can request a quote for Dioctyl 2-hydroxybutanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dioctyl 2-hydroxybutanedioate?
Yes, CoreyChem provides custom synthesis services for Dioctyl 2-hydroxybutanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.