Allyl n-octyl ether
TL;DR: Allyl n-octyl ether (CAS 3295-97-4) is a chemical compound with molecular formula C11H22O and molecular weight 170.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-2-enoxyoctane
Also Known As: Allyl n-octyl ether, Allyl octyl ether, 1-(allyloxy)octane, Allyloxyoctane, 1-prop-2-enoxyoctane
| Molecular Formula | C11H22O |
|---|---|
| Molecular Weight | 170.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 170.16707 |
| Heavy Atoms | 12 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 3295-97-4 |
|---|---|
| SMILES | CCCCCCCCOCC=C |
| InChIKey | IELYMBBIHQDONA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allyl n-octyl ether (CAS 3295-97-4), with molecular formula C11H22O and molecular weight 170.17 g/mol. IUPAC: 1-prop-2-enoxyoctane.
Chemical Property Profile of Allyl n-octyl ether
Property Insights of Allyl n-octyl ether
The XLogP value of 4.1 indicates that Allyl n-octyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Allyl n-octyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl n-octyl ether has 0 hydrogen bond donor(s) and 1 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 Allyl n-octyl ether?
The CAS number of Allyl n-octyl ether is 3295-97-4.
What is the molecular formula of Allyl n-octyl ether?
The molecular formula of Allyl n-octyl ether is C11H22O.
What is the molecular weight of Allyl n-octyl ether?
The molecular weight of Allyl n-octyl ether is 170.17 g/mol.
Where can I buy Allyl n-octyl ether?
You can request a quote for Allyl n-octyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl n-octyl ether?
Yes, KEHONG BIO provides custom synthesis services for Allyl n-octyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.