4-Fluoro-4'-(phenylethynyl)benzophenone
TL;DR: 4-Fluoro-4'-(phenylethynyl)benzophenone (CAS 153354-46-2) is a chemical compound with molecular formula C21H13FO and molecular weight 300.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)-[4-(2-phenylethynyl)phenyl]methanone
Also Known As: 4-Fluoro-4'-(phenylethynyl)benzophenone, (4-Fluorophenyl)(4-(phenylethynyl)phenyl)methanone, (4-fluorophenyl)-[4-(2-phenylethynyl)phenyl]methanone, 4-Fluoro-4/'-(phenylethynyl)benzophenone, 4-fluoro-4'-phenylethynyibenzophenone
| Molecular Formula | C21H13FO |
|---|---|
| Molecular Weight | 300.10 g/mol |
| LogP | 4.4565 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.09503 |
| Heavy Atoms | 23 |
| Complexity | 867.12476 |
Chemical Identifiers
| CAS Number | 153354-46-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)F |
Product Overview
4-Fluoro-4'-(phenylethynyl)benzophenone (CAS 153354-46-2), with molecular formula C21H13FO and molecular weight 300.10 g/mol. IUPAC: (4-fluorophenyl)-[4-(2-phenylethynyl)phenyl]methanone.
Chemical Property Profile of 4-Fluoro-4'-(phenylethynyl)benzophenone
Property Insights of 4-Fluoro-4'-(phenylethynyl)benzophenone
The XLogP value of 4.4565 indicates that 4-Fluoro-4'-(phenylethynyl)benzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Fluoro-4'-(phenylethynyl)benzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluoro-4'-(phenylethynyl)benzophenone 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 4-Fluoro-4'-(phenylethynyl)benzophenone?
The CAS number of 4-Fluoro-4'-(phenylethynyl)benzophenone is 153354-46-2.
What is the molecular formula of 4-Fluoro-4'-(phenylethynyl)benzophenone?
The molecular formula of 4-Fluoro-4'-(phenylethynyl)benzophenone is C21H13FO.
What is the molecular weight of 4-Fluoro-4'-(phenylethynyl)benzophenone?
The molecular weight of 4-Fluoro-4'-(phenylethynyl)benzophenone is 300.10 g/mol.
Where can I buy 4-Fluoro-4'-(phenylethynyl)benzophenone?
You can request a quote for 4-Fluoro-4'-(phenylethynyl)benzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluoro-4'-(phenylethynyl)benzophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluoro-4'-(phenylethynyl)benzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.