2,5,10-Undecatrienoic acid, methyl ester
TL;DR: 2,5,10-Undecatrienoic acid, methyl ester (CAS 57467-59-1) 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.
methyl (2E,5E)-undeca-2,5,10-trienoate
Also Known As: methyl undeca-2,5,10-trienoate, 2,5,10-Undecatrienoic acid, methyl ester, 2,5,10-Undecatrienoic acid methyl ester, Methyl (2E,5E)-2,5,10-undecatrienoate, methyl (2E,5E)-undeca-2,5,10-trienoate
| 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 | 7 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 214.36162 |
Chemical Identifiers
| CAS Number | 57467-59-1 |
|---|---|
| SMILES | COC(=O)/C=C/C/C=C/CCCC=C |
Product Overview
2,5,10-Undecatrienoic acid, methyl ester (CAS 57467-59-1), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: methyl (2E,5E)-undeca-2,5,10-trienoate.
Chemical Property Profile of 2,5,10-Undecatrienoic acid, methyl ester
Property Insights of 2,5,10-Undecatrienoic acid, methyl ester
The XLogP value of 3.0182 indicates that 2,5,10-Undecatrienoic acid, methyl 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, 2,5,10-Undecatrienoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5,10-Undecatrienoic acid, methyl 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 2,5,10-Undecatrienoic acid, methyl ester?
The CAS number of 2,5,10-Undecatrienoic acid, methyl ester is 57467-59-1.
What is the molecular formula of 2,5,10-Undecatrienoic acid, methyl ester?
The molecular formula of 2,5,10-Undecatrienoic acid, methyl ester is C12H18O2.
What is the molecular weight of 2,5,10-Undecatrienoic acid, methyl ester?
The molecular weight of 2,5,10-Undecatrienoic acid, methyl ester is 194.13 g/mol.
Where can I buy 2,5,10-Undecatrienoic acid, methyl ester?
You can request a quote for 2,5,10-Undecatrienoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5,10-Undecatrienoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,5,10-Undecatrienoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.