1-Propoxyoctane
TL;DR: 1-Propoxyoctane (CAS 29379-41-7) is a chemical compound with molecular formula C11H24O and molecular weight 172.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propoxyoctane
Also Known As: 1-Propoxyoctane, Octane, 1-propoxy-, Ether, octyl propyl, Octyl propyl ether, Octylpropyl ether
| Molecular Formula | C11H24O |
|---|---|
| Molecular Weight | 172.18 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 172.18271 |
| Heavy Atoms | 12 |
| Complexity | 71.0 |
Chemical Identifiers
| CAS Number | 29379-41-7 |
|---|---|
| SMILES | CCCCCCCCOCCC |
| InChIKey | KPFDWNLAMXJSNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propoxyoctane (CAS 29379-41-7), with molecular formula C11H24O and molecular weight 172.18 g/mol. IUPAC: 1-propoxyoctane.
Chemical Property Profile of 1-Propoxyoctane
Property Insights of 1-Propoxyoctane
The XLogP value of 4.4 indicates that 1-Propoxyoctane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Propoxyoctane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propoxyoctane 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 1-Propoxyoctane?
The CAS number of 1-Propoxyoctane is 29379-41-7.
What is the molecular formula of 1-Propoxyoctane?
The molecular formula of 1-Propoxyoctane is C11H24O.
What is the molecular weight of 1-Propoxyoctane?
The molecular weight of 1-Propoxyoctane is 172.18 g/mol.
Where can I buy 1-Propoxyoctane?
You can request a quote for 1-Propoxyoctane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propoxyoctane?
Yes, KEHONG BIO provides custom synthesis services for 1-Propoxyoctane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.