Octa-2,6-dienyl acetate
TL;DR: Octa-2,6-dienyl acetate (CAS 85554-65-0) 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.
octa-2,6-dienyl acetate
Also Known As: (2E,6Z)-Octa-2,6-dienyl acetate, EINECS 287-597-3
| 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 | 5 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 168.6774 |
Chemical Identifiers
| CAS Number | 85554-65-0 |
|---|---|
| SMILES | CC=CCCC=CCOC(=O)C |
Product Overview
Octa-2,6-dienyl acetate (CAS 85554-65-0), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: octa-2,6-dienyl acetate.
Chemical Property Profile of Octa-2,6-dienyl acetate
Property Insights of Octa-2,6-dienyl acetate
The XLogP value of 2.462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octa-2,6-dienyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Octa-2,6-dienyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octa-2,6-dienyl acetate 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 Octa-2,6-dienyl acetate?
The CAS number of Octa-2,6-dienyl acetate is 85554-65-0.
What is the molecular formula of Octa-2,6-dienyl acetate?
The molecular formula of Octa-2,6-dienyl acetate is C10H16O2.
What is the molecular weight of Octa-2,6-dienyl acetate?
The molecular weight of Octa-2,6-dienyl acetate is 168.12 g/mol.
Where can I buy Octa-2,6-dienyl acetate?
You can request a quote for Octa-2,6-dienyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octa-2,6-dienyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Octa-2,6-dienyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.