1-Ethyl-4-propoxybenzene
TL;DR: 1-Ethyl-4-propoxybenzene (CAS 500862-87-3) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-4-propoxybenzene
Also Known As: 1-ethyl-4-propoxybenzene, 4-Ethylphenylpropyl ether, 1-Propoxy-4-ethylbenzene, RefChem:230351
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 500862-87-3 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)CC |
| InChIKey | RLDLEJMDDRVSEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethyl-4-propoxybenzene (CAS 500862-87-3), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 1-ethyl-4-propoxybenzene.
Chemical Property Profile of 1-Ethyl-4-propoxybenzene
Property Insights of 1-Ethyl-4-propoxybenzene
The XLogP value of 3.6 indicates that 1-Ethyl-4-propoxybenzene 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-Ethyl-4-propoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-4-propoxybenzene 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-Ethyl-4-propoxybenzene?
The CAS number of 1-Ethyl-4-propoxybenzene is 500862-87-3.
What is the molecular formula of 1-Ethyl-4-propoxybenzene?
The molecular formula of 1-Ethyl-4-propoxybenzene is C11H16O.
What is the molecular weight of 1-Ethyl-4-propoxybenzene?
The molecular weight of 1-Ethyl-4-propoxybenzene is 164.12 g/mol.
Where can I buy 1-Ethyl-4-propoxybenzene?
You can request a quote for 1-Ethyl-4-propoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-4-propoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-4-propoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.