Benzyl octyl ether
TL;DR: Benzyl octyl ether (CAS 54852-64-1) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octoxymethylbenzene
Also Known As: Benzyl octyl ether, Octyl benzyl ether, Benzyl N-octyl ether, octoxymethylbenzene, Benzyloctyl ether
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 54852-64-1 |
|---|---|
| SMILES | CCCCCCCCOCC1=CC=CC=C1 |
| InChIKey | NXZJVIKVJAKQOU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl octyl ether (CAS 54852-64-1), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: octoxymethylbenzene.
Chemical Property Profile of Benzyl octyl ether
Property Insights of Benzyl octyl ether
The XLogP value of 5.0 indicates that Benzyl 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, Benzyl octyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 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 Benzyl octyl ether?
The CAS number of Benzyl octyl ether is 54852-64-1.
What is the molecular formula of Benzyl octyl ether?
The molecular formula of Benzyl octyl ether is C15H24O.
What is the molecular weight of Benzyl octyl ether?
The molecular weight of Benzyl octyl ether is 220.18 g/mol.
Where can I buy Benzyl octyl ether?
You can request a quote for Benzyl octyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl octyl ether?
Yes, KEHONG BIO provides custom synthesis services for Benzyl octyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.