Ethyl 2-ethylbutyrate
TL;DR: Ethyl 2-ethylbutyrate (CAS 2983-38-2) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-ethylbutanoate
Also Known As: Ethyl 2-ethylbutanoate, Ethyl 2-ethylbutyrate, Etzadroxil, 2-Ethyl-n-butyric acid ethyl ester, Butanoic acid, 2-ethyl-, ethyl ester
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 95.0 |
| Boiling Point | 156.00 to 157.00 °C. @ 760.00 mm Hg |
| Density | 0.865 - 0.871 |
| Solubility | Practically insoluble or insoluble |
| Refractive Index | 1.401 - 1.407 |
Chemical Identifiers
| CAS Number | 2983-38-2 |
|---|---|
| SMILES | CCC(CC)C(=O)OCC |
| InChIKey | MJGSLNIPTRPYJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-ethylbutyrate (CAS 2983-38-2), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: ethyl 2-ethylbutanoate.
Chemical Property Profile of Ethyl 2-ethylbutyrate
Property Insights of Ethyl 2-ethylbutyrate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-ethylbutyrate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-ethylbutyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-ethylbutyrate 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 Ethyl 2-ethylbutyrate?
The CAS number of Ethyl 2-ethylbutyrate is 2983-38-2.
What is the molecular formula of Ethyl 2-ethylbutyrate?
The molecular formula of Ethyl 2-ethylbutyrate is C8H16O2.
What is the molecular weight of Ethyl 2-ethylbutyrate?
The molecular weight of Ethyl 2-ethylbutyrate is 144.12 g/mol.
Where can I buy Ethyl 2-ethylbutyrate?
You can request a quote for Ethyl 2-ethylbutyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-ethylbutyrate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-ethylbutyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.