![1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene structure](/static/products/123/123770-66-1.png)
1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene
TL;DR: 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene (CAS 123770-66-1) is a chemical compound with molecular formula C17H14O and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(4-methylphenyl)ethynyl]phenyl]ethanone
Also Known As: 4 -(p-Tolylethynyl)acetophenone, 4 -(4-Methylphenylethynyl)acetophenone, 4 -[(4-Methylphenyl)ethynyl]acetophenone, 1-[4-[2-(4-methylphenyl)ethynyl]phenyl]ethanone, J1.142.041I
| Molecular Formula | C17H14O |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 3.59742 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.10446 |
| Heavy Atoms | 18 |
| Complexity | 607.39996 |
Chemical Identifiers
| CAS Number | 123770-66-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)C |
Product Overview
1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene (CAS 123770-66-1), with molecular formula C17H14O and molecular weight 234.10 g/mol. IUPAC: 1-[4-[2-(4-methylphenyl)ethynyl]phenyl]ethanone.
Chemical Property Profile of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene
Property Insights of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene
The XLogP value of 3.59742 indicates that 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetyl-4-[2-(4-methylphenyl)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-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene?
The CAS number of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene is 123770-66-1.
What is the molecular formula of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene?
The molecular formula of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene is C17H14O.
What is the molecular weight of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene?
The molecular weight of 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene is 234.10 g/mol.
Where can I buy 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene?
You can request a quote for 1-Acetyl-4-[2-(4-methylphenyl)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-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-4-[2-(4-methylphenyl)ethynyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.