3,7,11-Trimethyldodeca-2,4,10-trienoic acid
TL;DR: 3,7,11-Trimethyldodeca-2,4,10-trienoic acid (CAS 40596-48-3) is a chemical compound with molecular formula C15H24O2 and molecular weight 236.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,11-trimethyldodeca-2,4,10-trienoic acid
Also Known As: 3,7,11-trimethyldodeca-2,4,10-trienoic acid, 2,4,10-Dodecatrienoic acid,3,7,11-trimethyl, 2,4,10-Dodecatrienoic acid, 3,7,11-trimethyl-, 2,4,10-Dodecatrienoic acid, 3,7,11-trimethyl-, (E,E)-
| Molecular Formula | C15H24O2 |
|---|---|
| Molecular Weight | 236.18 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.17763 |
| Heavy Atoms | 17 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 40596-48-3 |
|---|---|
| SMILES | CC(CCC=C(C)C)CC=CC(=CC(=O)O)C |
| InChIKey | PJXNSLRVBKVDHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,7,11-Trimethyldodeca-2,4,10-trienoic acid (CAS 40596-48-3), with molecular formula C15H24O2 and molecular weight 236.18 g/mol. IUPAC: 3,7,11-trimethyldodeca-2,4,10-trienoic acid.
Chemical Property Profile of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid
Property Insights of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid
The XLogP value of 5.1 indicates that 3,7,11-Trimethyldodeca-2,4,10-trienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,7,11-Trimethyldodeca-2,4,10-trienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7,11-Trimethyldodeca-2,4,10-trienoic acid has 1 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 3,7,11-Trimethyldodeca-2,4,10-trienoic acid?
The CAS number of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid is 40596-48-3.
What is the molecular formula of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid?
The molecular formula of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid is C15H24O2.
What is the molecular weight of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid?
The molecular weight of 3,7,11-Trimethyldodeca-2,4,10-trienoic acid is 236.18 g/mol.
Where can I buy 3,7,11-Trimethyldodeca-2,4,10-trienoic acid?
You can request a quote for 3,7,11-Trimethyldodeca-2,4,10-trienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7,11-Trimethyldodeca-2,4,10-trienoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,7,11-Trimethyldodeca-2,4,10-trienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.