Ethyl 2,4,7-decatrienoate
TL;DR: Ethyl 2,4,7-decatrienoate (CAS 78417-28-4) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl deca-2,4,7-trienoate
Also Known As: Ethyl 2,4,7-decatrienoate, ethyl deca-2,4,7-trienoate, Ethyl2,4,7-decatrienoate, 2,4,7-Decatrienoic acid, ethyl ester, FEMA NO. 3832
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 3.0182 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 224.47623 |
Chemical Identifiers
| CAS Number | 78417-28-4 |
|---|---|
| SMILES | CCC=CCC=CC=CC(=O)OCC |
Product Overview
Ethyl 2,4,7-decatrienoate (CAS 78417-28-4), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: ethyl deca-2,4,7-trienoate.
Chemical Property Profile of Ethyl 2,4,7-decatrienoate
Property Insights of Ethyl 2,4,7-decatrienoate
The XLogP value of 3.0182 indicates that Ethyl 2,4,7-decatrienoate 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 2,4,7-decatrienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2,4,7-decatrienoate 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 2,4,7-decatrienoate?
The CAS number of Ethyl 2,4,7-decatrienoate is 78417-28-4.
What is the molecular formula of Ethyl 2,4,7-decatrienoate?
The molecular formula of Ethyl 2,4,7-decatrienoate is C12H18O2.
What is the molecular weight of Ethyl 2,4,7-decatrienoate?
The molecular weight of Ethyl 2,4,7-decatrienoate is 194.13 g/mol.
Where can I buy Ethyl 2,4,7-decatrienoate?
You can request a quote for Ethyl 2,4,7-decatrienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4,7-decatrienoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4,7-decatrienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.