3,7-Dimethylocta-2,6-dienyl undec-10-enoate
TL;DR: 3,7-Dimethylocta-2,6-dienyl undec-10-enoate (CAS 68892-05-7) is a chemical compound with molecular formula C21H36O2 and molecular weight 320.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethylocta-2,6-dienyl undec-10-enoate
Also Known As: Geranyl Undecylenate, Geranyl undec-10-enylate, 3,7-Dimethylocta-2,6-dienyl undec-10-enoate, 10-Undecenoic acid, 3,7-dimethyl-2,6-octadien-1-yl ester, 10-Undecenoic acid, 3,7-dimethyl-2,6-octadienyl ester
| Molecular Formula | C21H36O2 |
|---|---|
| Molecular Weight | 320.27 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 320.27155 |
| Heavy Atoms | 23 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 68892-05-7 |
|---|---|
| SMILES | CC(=CCCC(=CCOC(=O)CCCCCCCCC=C)C)C |
| InChIKey | LUZKKLNTWSGPEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,7-Dimethylocta-2,6-dienyl undec-10-enoate (CAS 68892-05-7), with molecular formula C21H36O2 and molecular weight 320.27 g/mol. IUPAC: 3,7-dimethylocta-2,6-dienyl undec-10-enoate.
Chemical Property Profile of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate
Property Insights of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate
The XLogP value of 7.6 indicates that 3,7-Dimethylocta-2,6-dienyl undec-10-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,7-Dimethylocta-2,6-dienyl undec-10-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dimethylocta-2,6-dienyl undec-10-enoate 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 3,7-Dimethylocta-2,6-dienyl undec-10-enoate?
The CAS number of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate is 68892-05-7.
What is the molecular formula of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate?
The molecular formula of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate is C21H36O2.
What is the molecular weight of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate?
The molecular weight of 3,7-Dimethylocta-2,6-dienyl undec-10-enoate is 320.27 g/mol.
Where can I buy 3,7-Dimethylocta-2,6-dienyl undec-10-enoate?
You can request a quote for 3,7-Dimethylocta-2,6-dienyl undec-10-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dimethylocta-2,6-dienyl undec-10-enoate?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethylocta-2,6-dienyl undec-10-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.