2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-
TL;DR: 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- (CAS 55283-13-1) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E,6E)-3-methylocta-2,6-dienoate
Also Known As: methyl (2E,6E)-3-methylocta-2,6-dienoate, Methyl (2E,6Z)-3-methyl-2,6-octadienoate, 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-, (2E,6E)-3-Methyl-2,6-octadienoic acid methyl ester, 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,E)-
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.462 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 190.01526 |
Chemical Identifiers
| CAS Number | 55283-13-1 |
|---|---|
| SMILES | C/C=C/CC/C(=C/C(=O)OC)/C |
Product Overview
2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- (CAS 55283-13-1), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: methyl (2E,6E)-3-methylocta-2,6-dienoate.
Chemical Property Profile of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-
Property Insights of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-
The XLogP value of 2.462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-. With a topological polar surface area (TPSA) of 26.3 Ų, 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- 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-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-?
The CAS number of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- is 55283-13-1.
What is the molecular formula of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-?
The molecular formula of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- is C10H16O2.
What is the molecular weight of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-?
The molecular weight of 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- is 168.12 g/mol.
Where can I buy 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-?
You can request a quote for 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Octadienoic acid, 3-methyl-, methyl ester, (E,Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.