Ethyl (E)-2-octenoate
TL;DR: Ethyl (E)-2-octenoate (CAS 7367-82-0) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl oct-2-enoate
Also Known As: Ethyl 2-octenoate, ethyl trans-2-octenoate, Ethyl oct-2-enoate, ethyl octenoate, 2-Octenoic acid, ethyl ester
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 7367-82-0 |
|---|---|
| SMILES | CCCCCC=CC(=O)OCC |
| InChIKey | AISZSTYLOVXFII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl (E)-2-octenoate (CAS 7367-82-0), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: ethyl oct-2-enoate.
Chemical Property Profile of Ethyl (E)-2-octenoate
Property Insights of Ethyl (E)-2-octenoate
The XLogP value of 3.4 indicates that Ethyl (E)-2-octenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl (E)-2-octenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (E)-2-octenoate 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 (E)-2-octenoate?
The CAS number of Ethyl (E)-2-octenoate is 7367-82-0.
What is the molecular formula of Ethyl (E)-2-octenoate?
The molecular formula of Ethyl (E)-2-octenoate is C10H18O2.
What is the molecular weight of Ethyl (E)-2-octenoate?
The molecular weight of Ethyl (E)-2-octenoate is 170.13 g/mol.
Where can I buy Ethyl (E)-2-octenoate?
You can request a quote for Ethyl (E)-2-octenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (E)-2-octenoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (E)-2-octenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.