Oxalic acid, 2-ethylhexyl hexyl ester
TL;DR: Oxalic acid, 2-ethylhexyl hexyl ester (CAS 959068-01-0) is a chemical compound with molecular formula C16H30O4 and molecular weight 286.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-(2-ethylhexyl) 1-O-hexyl oxalate
Also Known As: Oxalic acid, 2-ethylhexyl hexyl ester, 2-O-(2-ethylhexyl) 1-O-hexyl oxalate, Ethanedioic acid, 1-(2-ethylhexyl) 2-hexyl ester
| Molecular Formula | C16H30O4 |
|---|---|
| Molecular Weight | 286.21 g/mol |
| LogP | 3.8695 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 286.21442 |
| Heavy Atoms | 20 |
| Complexity | 263.20248 |
Chemical Identifiers
| CAS Number | 959068-01-0 |
|---|---|
| SMILES | CCCCCCOC(=O)C(=O)OCC(CC)CCCC |
Product Overview
Oxalic acid, 2-ethylhexyl hexyl ester (CAS 959068-01-0), with molecular formula C16H30O4 and molecular weight 286.21 g/mol. IUPAC: 2-O-(2-ethylhexyl) 1-O-hexyl oxalate.
Chemical Property Profile of Oxalic acid, 2-ethylhexyl hexyl ester
Property Insights of Oxalic acid, 2-ethylhexyl hexyl ester
The XLogP value of 3.8695 indicates that Oxalic acid, 2-ethylhexyl hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Oxalic acid, 2-ethylhexyl hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxalic acid, 2-ethylhexyl hexyl ester 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 Oxalic acid, 2-ethylhexyl hexyl ester?
The CAS number of Oxalic acid, 2-ethylhexyl hexyl ester is 959068-01-0.
What is the molecular formula of Oxalic acid, 2-ethylhexyl hexyl ester?
The molecular formula of Oxalic acid, 2-ethylhexyl hexyl ester is C16H30O4.
What is the molecular weight of Oxalic acid, 2-ethylhexyl hexyl ester?
The molecular weight of Oxalic acid, 2-ethylhexyl hexyl ester is 286.21 g/mol.
Where can I buy Oxalic acid, 2-ethylhexyl hexyl ester?
You can request a quote for Oxalic acid, 2-ethylhexyl hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalic acid, 2-ethylhexyl hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Oxalic acid, 2-ethylhexyl hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.