Methyl dodeca-3,6-dienoate
TL;DR: Methyl dodeca-3,6-dienoate (CAS 16106-01-7) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl dodeca-3,6-dienoate
Also Known As: METHYL DODECA-3,6-DIENOATE, 3,6-Dodecadienoic acid methyl ester, 3,6-Dodecadienoic acid, methyl ester, RefChem:356647
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 16106-01-7 |
|---|---|
| SMILES | CCCCCC=CCC=CCC(=O)OC |
| InChIKey | QOLQXDRXMBPSFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl dodeca-3,6-dienoate (CAS 16106-01-7), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: methyl dodeca-3,6-dienoate.
Chemical Property Profile of Methyl dodeca-3,6-dienoate
Property Insights of Methyl dodeca-3,6-dienoate
The XLogP value of 4.1 indicates that Methyl dodeca-3,6-dienoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl dodeca-3,6-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl dodeca-3,6-dienoate 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 Methyl dodeca-3,6-dienoate?
The CAS number of Methyl dodeca-3,6-dienoate is 16106-01-7.
What is the molecular formula of Methyl dodeca-3,6-dienoate?
The molecular formula of Methyl dodeca-3,6-dienoate is C13H22O2.
What is the molecular weight of Methyl dodeca-3,6-dienoate?
The molecular weight of Methyl dodeca-3,6-dienoate is 210.16 g/mol.
Where can I buy Methyl dodeca-3,6-dienoate?
You can request a quote for Methyl dodeca-3,6-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl dodeca-3,6-dienoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl dodeca-3,6-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.