Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride
TL;DR: Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride (CAS 82101-06-2) is a chemical compound with molecular formula C11H15ClFNO and molecular weight 231.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanone;hydrochloride
Also Known As: N-(4-Fluorophenacyl)-isopropylamine hydrochloride, Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride, 1-(4-Fluorophenyl)-2-((1-methylethyl)amino)ethanone hydrochloride, 1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanone,hydrochloride, 1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanone hydrochloride
| Molecular Formula | C11H15ClFNO |
|---|---|
| Molecular Weight | 231.08 g/mol |
| LogP | 2.4282 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.08263 |
| Heavy Atoms | 15 |
| Complexity | 310.8689 |
Chemical Identifiers
| CAS Number | 82101-06-2 |
|---|---|
| SMILES | CC(C)NCC(=O)C1=CC=C(C=C1)F.Cl |
Product Overview
Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride (CAS 82101-06-2), with molecular formula C11H15ClFNO and molecular weight 231.08 g/mol. IUPAC: 1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanone;hydrochloride.
Chemical Property Profile of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride
Property Insights of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride
The XLogP value of 2.4282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride. With a topological polar surface area (TPSA) of 29.1 Ų, Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride has 1 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 Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride?
The CAS number of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride is 82101-06-2.
What is the molecular formula of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride?
The molecular formula of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride is C11H15ClFNO.
What is the molecular weight of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride?
The molecular weight of Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride is 231.08 g/mol.
Where can I buy Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride?
You can request a quote for Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-fluorophenyl)-2-((1-methylethyl)amino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.