2,6-Decadienoic acid, ethyl ester
TL;DR: 2,6-Decadienoic acid, ethyl ester (CAS 68039-70-3) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl deca-2,6-dienoate
Also Known As: Ethyl 2,6-decadienoate, 2,6-Decadienoic acid, ethyl ester, Ethyl (2E,6E)-2,6-decadienoate, 2,6-DECADIENOIC ACID ETHYL ESTER, 2,6-Decadienoic acid, ethyl ester, (2E,6E)-
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 68039-70-3 |
|---|---|
| SMILES | CCCC=CCCC=CC(=O)OCC |
| InChIKey | IKYQRQZDESYHSL-UHFFFAOYSA-N |
Product Overview
2,6-Decadienoic acid, ethyl ester (CAS 68039-70-3), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: ethyl deca-2,6-dienoate.
Chemical Property Profile of 2,6-Decadienoic acid, ethyl ester
Property Insights of 2,6-Decadienoic acid, ethyl ester
The XLogP value of 3.5 indicates that 2,6-Decadienoic acid, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,6-Decadienoic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Decadienoic acid, ethyl ester 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 2,6-Decadienoic acid, ethyl ester?
The CAS number of 2,6-Decadienoic acid, ethyl ester is 68039-70-3.
What is the molecular formula of 2,6-Decadienoic acid, ethyl ester?
The molecular formula of 2,6-Decadienoic acid, ethyl ester is C12H20O2.
What is the molecular weight of 2,6-Decadienoic acid, ethyl ester?
The molecular weight of 2,6-Decadienoic acid, ethyl ester is 196.15 g/mol.
Where can I buy 2,6-Decadienoic acid, ethyl ester?
You can request a quote for 2,6-Decadienoic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Decadienoic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Decadienoic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.