1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene
TL;DR: 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene (CAS 63221-88-5) is a chemical compound with molecular formula C17H16O and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene
Also Known As: 1-Ethyl-4-[(4-methoxyphenyl)ethynyl]benzene, 2PMeOPa, 1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene, 1-(4-ETHYLPHENYL)-2-(4-METHOXYPHENYL)ACETYLENE, 1-Ethyl-4-((4-methoxyphenyl)ethynyl)benzene
| Molecular Formula | C17H16O |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 3.6574 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.12012 |
| Heavy Atoms | 18 |
| Complexity | 501.79935 |
Chemical Identifiers
| CAS Number | 63221-88-5 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OC |
Product Overview
1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene (CAS 63221-88-5), with molecular formula C17H16O and molecular weight 236.12 g/mol. IUPAC: 1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene.
Chemical Property Profile of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene
Property Insights of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene
The XLogP value of 3.6574 indicates that 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene 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-(2-(4-methoxyphenyl)ethynyl)benzene?
The CAS number of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene is 63221-88-5.
What is the molecular formula of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene?
The molecular formula of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene is C17H16O.
What is the molecular weight of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene?
The molecular weight of 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene is 236.12 g/mol.
Where can I buy 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene?
You can request a quote for 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene 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-(2-(4-methoxyphenyl)ethynyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-4-(2-(4-methoxyphenyl)ethynyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.