Dihexyl oxalate
TL;DR: Dihexyl oxalate (CAS 20602-87-3) is a chemical compound with molecular formula C14H26O4 and molecular weight 258.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dihexyl oxalate
Also Known As: Dihexyl oxalate, di-n-hexyl oxalate, Dihexyl ethanedioate, Oxalic acid dihexyl ester, Ethanedioic acid, dihexyl ester
| Molecular Formula | C14H26O4 |
|---|---|
| Molecular Weight | 258.18 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 258.1831 |
| Heavy Atoms | 18 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 20602-87-3 |
|---|---|
| SMILES | CCCCCCOC(=O)C(=O)OCCCCCC |
| InChIKey | VIGLJKSIDLNMGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihexyl oxalate (CAS 20602-87-3), with molecular formula C14H26O4 and molecular weight 258.18 g/mol. IUPAC: dihexyl oxalate.
Chemical Property Profile of Dihexyl oxalate
Property Insights of Dihexyl oxalate
The XLogP value of 4.5 indicates that Dihexyl oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dihexyl oxalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihexyl oxalate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihexyl oxalate?
The CAS number of Dihexyl oxalate is 20602-87-3.
What is the molecular formula of Dihexyl oxalate?
The molecular formula of Dihexyl oxalate is C14H26O4.
What is the molecular weight of Dihexyl oxalate?
The molecular weight of Dihexyl oxalate is 258.18 g/mol.
Where can I buy Dihexyl oxalate?
You can request a quote for Dihexyl oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihexyl oxalate?
Yes, KEHONG BIO provides custom synthesis services for Dihexyl oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.