![Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- structure](/static/products/910/91068-82-5.png)
Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-
TL;DR: Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- (CAS 91068-82-5) is a chemical compound with molecular formula C12H16FNO and molecular weight 209.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(tert-butylamino)-1-(4-fluorophenyl)ethanone
Also Known As: 2-(tert-butylamino)-1-(4-fluorophenyl)ethanone, 2-(tert-butylamino)-1-(4-fluorophenyl)ethan-1-one, Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-, 1-(4-fluorophenyl)-2-(tert-butylamino)ethanone, AM-814/41093115
| Molecular Formula | C12H16FNO |
|---|---|
| Molecular Weight | 209.12 g/mol |
| LogP | 2.3965 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.1216 |
| Heavy Atoms | 15 |
| Complexity | 337.63492 |
Chemical Identifiers
| CAS Number | 91068-82-5 |
|---|---|
| SMILES | CC(C)(C)NCC(=O)C1=CC=C(C=C1)F |
Product Overview
Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- (CAS 91068-82-5), with molecular formula C12H16FNO and molecular weight 209.12 g/mol. IUPAC: 2-(tert-butylamino)-1-(4-fluorophenyl)ethanone.
Chemical Property Profile of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-
Property Insights of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-
The XLogP value of 2.3965 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-. With a topological polar surface area (TPSA) of 29.1 Ų, Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- 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, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-?
The CAS number of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- is 91068-82-5.
What is the molecular formula of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-?
The molecular formula of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- is C12H16FNO.
What is the molecular weight of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-?
The molecular weight of Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- is 209.12 g/mol.
Where can I buy Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-?
You can request a quote for Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-[(1,1-dimethylethyl)amino]-1-(4-fluorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.