![1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one structure](/static/products/2869/28698-48-8.webp)
1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one
TL;DR: 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one (CAS 28698-48-8) is a chemical compound with molecular formula C13H16FNO and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluoro-4-piperidin-1-ylphenyl)ethanone
Also Known As: 1-(3-fluoro-4-piperidin-1-ylphenyl)ethanone, 1-[3-fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one, 1-acetyl-3-fluoro-4-piperidylbenzene, BAS 03154120, 1-[3-fluoro-4-(1-piperidyl)phenyl]ethanone
| Molecular Formula | C13H16FNO |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.1216 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 28698-48-8 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)N2CCCCC2)F |
| InChIKey | AOKPJIGYKRAPCQ-UHFFFAOYSA-N |
Product Overview
1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one (CAS 28698-48-8), with molecular formula C13H16FNO and molecular weight 221.12 g/mol. IUPAC: 1-(3-fluoro-4-piperidin-1-ylphenyl)ethanone.
Chemical Property Profile of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one
Property Insights of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one. With a topological polar surface area (TPSA) of 20.3 Ų, 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one has 0 hydrogen bond donor(s) and 3 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-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one?
The CAS number of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one is 28698-48-8.
What is the molecular formula of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one?
The molecular formula of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one is C13H16FNO.
What is the molecular weight of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one?
The molecular weight of 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one is 221.12 g/mol.
Where can I buy 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one?
You can request a quote for 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-Fluoro-4-(piperidin-1-yl)phenyl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.