Ethyl hexa-2,4-dienoate
TL;DR: Ethyl hexa-2,4-dienoate (CAS 2396-84-1) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl hexa-2,4-dienoate
Also Known As: ETHYL SORBATE, ethylsorbate, Ethyl hexa-2,4-dienoate, ETHYL HEXADIENOATE, Ethyl 2,4-hexadienoate
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 2396-84-1 |
|---|---|
| SMILES | CCOC(=O)C=CC=CC |
| InChIKey | OZZYKXXGCOLLLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl hexa-2,4-dienoate (CAS 2396-84-1), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: ethyl hexa-2,4-dienoate.
Chemical Property Profile of Ethyl hexa-2,4-dienoate
Property Insights of Ethyl hexa-2,4-dienoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl hexa-2,4-dienoate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl hexa-2,4-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl hexa-2,4-dienoate 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 hexa-2,4-dienoate?
The CAS number of Ethyl hexa-2,4-dienoate is 2396-84-1.
What is the molecular formula of Ethyl hexa-2,4-dienoate?
The molecular formula of Ethyl hexa-2,4-dienoate is C8H12O2.
What is the molecular weight of Ethyl hexa-2,4-dienoate?
The molecular weight of Ethyl hexa-2,4-dienoate is 140.08 g/mol.
Where can I buy Ethyl hexa-2,4-dienoate?
You can request a quote for Ethyl hexa-2,4-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl hexa-2,4-dienoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl hexa-2,4-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.