Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate
TL;DR: Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate (CAS 33776-65-7) is a chemical compound with molecular formula C17H28O2 and molecular weight 264.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate
Also Known As: ethyl farnesoate, ETHYL 3,7,11-TRIMETHYLDODECA-2,6,10-TRIENOATE, ethyl-3,7,11-trimethyldodeca-2,6,10-trienoate, 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, ethyl ester, (Z,Z)-, 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, ethyl ester, (2E,6Z)-
| Molecular Formula | C17H28O2 |
|---|---|
| Molecular Weight | 264.21 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 264.20892 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 33776-65-7 |
|---|---|
| SMILES | CCOC(=O)C=C(C)CCC=C(C)CCC=C(C)C |
| InChIKey | RAVLTUCAFRTDRY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate (CAS 33776-65-7), with molecular formula C17H28O2 and molecular weight 264.21 g/mol. IUPAC: ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate.
Chemical Property Profile of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate
Property Insights of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate
The XLogP value of 5.6 indicates that Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate 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 3,7,11-trimethyldodeca-2,6,10-trienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate?
The CAS number of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate is 33776-65-7.
What is the molecular formula of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate?
The molecular formula of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate is C17H28O2.
What is the molecular weight of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate?
The molecular weight of Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate is 264.21 g/mol.
Where can I buy Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate?
You can request a quote for Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,7,11-trimethyldodeca-2,6,10-trienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.