Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride
TL;DR: Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride (CAS 27922-13-0) is a chemical compound with molecular formula C15H21ClFNO and molecular weight 285.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-piperidin-1-ium-1-ylbutan-1-one chloride
Also Known As: 4'-Fluoro-3-piperidinobutyrophenone hydrochloride, BUTYROPHENONE, 4'-FLUORO-3-PIPERIDINO-, HYDROCHLORIDE, 1-(4-fluorophenyl)-3-piperidin-1-ium-1-ylbutan-1-one chloride, RefChem:1080515
| Molecular Formula | C15H21ClFNO |
|---|---|
| Molecular Weight | 285.13 g/mol |
| LogP | -1.14 |
| Topological Polar Surface Area | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.12958 |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 27922-13-0 |
|---|---|
| SMILES | CC(CC(=O)C1=CC=C(C=C1)F)[NH+]2CCCCC2.[Cl-] |
| InChIKey | BQEACQUTCAMDLJ-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride (CAS 27922-13-0), with molecular formula C15H21ClFNO and molecular weight 285.13 g/mol. IUPAC: 1-(4-fluorophenyl)-3-piperidin-1-ium-1-ylbutan-1-one chloride.
Chemical Property Profile of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride
Property Insights of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride
The XLogP value of -1.14 indicates that Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.5 Ų, Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride has 1 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 Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride?
The CAS number of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride is 27922-13-0.
What is the molecular formula of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride?
The molecular formula of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride is C15H21ClFNO.
What is the molecular weight of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride?
The molecular weight of Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride is 285.13 g/mol.
Where can I buy Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride?
You can request a quote for Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4'-fluoro-3-piperidino-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.