2-Ethylbutyl 2-ethylhexanoate
TL;DR: 2-Ethylbutyl 2-ethylhexanoate (CAS 7425-15-2) is a chemical compound with molecular formula C14H28O2 and molecular weight 228.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylbutyl 2-ethylhexanoate
Also Known As: 2-Ethylbutyl 2-ethylhexanoate, 2-ethylbutyl2-ethylhexanoate, 2-Ethylhexanoic acid 2-ethylbutyl ester, Hexanoic acid,2-ethyl-, 2-ethylbutyl ester, EINECS 231-058-7
| Molecular Formula | C14H28O2 |
|---|---|
| Molecular Weight | 228.21 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 228.20892 |
| Heavy Atoms | 16 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 7425-15-2 |
|---|---|
| SMILES | CCCCC(CC)C(=O)OCC(CC)CC |
| InChIKey | ZBFXGRJSIVCJDQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethylbutyl 2-ethylhexanoate (CAS 7425-15-2), with molecular formula C14H28O2 and molecular weight 228.21 g/mol. IUPAC: 2-ethylbutyl 2-ethylhexanoate.
Chemical Property Profile of 2-Ethylbutyl 2-ethylhexanoate
Property Insights of 2-Ethylbutyl 2-ethylhexanoate
The XLogP value of 5.0 indicates that 2-Ethylbutyl 2-ethylhexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Ethylbutyl 2-ethylhexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylbutyl 2-ethylhexanoate has 0 hydrogen bond donor(s) and 2 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 2-Ethylbutyl 2-ethylhexanoate?
The CAS number of 2-Ethylbutyl 2-ethylhexanoate is 7425-15-2.
What is the molecular formula of 2-Ethylbutyl 2-ethylhexanoate?
The molecular formula of 2-Ethylbutyl 2-ethylhexanoate is C14H28O2.
What is the molecular weight of 2-Ethylbutyl 2-ethylhexanoate?
The molecular weight of 2-Ethylbutyl 2-ethylhexanoate is 228.21 g/mol.
Where can I buy 2-Ethylbutyl 2-ethylhexanoate?
You can request a quote for 2-Ethylbutyl 2-ethylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylbutyl 2-ethylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylbutyl 2-ethylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.