4'-Fluoroacetophenone
TL;DR: 4'-Fluoroacetophenone (CAS 403-42-9) is a chemical compound with molecular formula C8H7FO and molecular weight 138.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)ethanone
Also Known As: 4'-Fluoroacetophenone, 1-(4-Fluorophenyl)ethanone, 4-FLUOROACETOPHENONE, p-Fluoroacetophenone, 1-(4-Fluorophenyl)Ethan-1-One
| Molecular Formula | C8H7FO |
|---|---|
| Molecular Weight | 138.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.0481 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
| Vapor Pressure | 0.75 [mmHg] |
Chemical Identifiers
| CAS Number | 403-42-9 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)F |
| InChIKey | ZDPAWHACYDRYIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Fluoroacetophenone (CAS 403-42-9), with molecular formula C8H7FO and molecular weight 138.05 g/mol. IUPAC: 1-(4-fluorophenyl)ethanone.
Chemical Property Profile of 4'-Fluoroacetophenone
Property Insights of 4'-Fluoroacetophenone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Fluoroacetophenone. With a topological polar surface area (TPSA) of 17.1 Ų, 4'-Fluoroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Fluoroacetophenone has 0 hydrogen bond donor(s) and 2 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'-Fluoroacetophenone?
The CAS number of 4'-Fluoroacetophenone is 403-42-9.
What is the molecular formula of 4'-Fluoroacetophenone?
The molecular formula of 4'-Fluoroacetophenone is C8H7FO.
What is the molecular weight of 4'-Fluoroacetophenone?
The molecular weight of 4'-Fluoroacetophenone is 138.05 g/mol.
Where can I buy 4'-Fluoroacetophenone?
You can request a quote for 4'-Fluoroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Fluoroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 4'-Fluoroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.