1-(2-Fluoro-5-nitrophenyl)ethan-1-one
TL;DR: 1-(2-Fluoro-5-nitrophenyl)ethan-1-one (CAS 57044-25-4) is a chemical compound with molecular formula C8H6FNO3 and molecular weight 183.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-fluoro-5-nitrophenyl)ethanone
Also Known As: 1-(2-fluoro-5-nitrophenyl)ethanone, 2'-Fluoro-5'-nitroacetophenone, 1-(2-fluoro-5-nitrophenyl)ethan-1-one, 2-fluoro-5-nitroacetophenone, (R)-Glycidol
| Molecular Formula | C8H6FNO3 |
|---|---|
| Molecular Weight | 183.03 g/mol |
| LogP | 1.9365 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.03317 |
| Heavy Atoms | 13 |
| Complexity | 375.65192 |
Chemical Identifiers
| CAS Number | 57044-25-4 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])F |
Product Overview
1-(2-Fluoro-5-nitrophenyl)ethan-1-one (CAS 57044-25-4), with molecular formula C8H6FNO3 and molecular weight 183.03 g/mol. IUPAC: 1-(2-fluoro-5-nitrophenyl)ethanone.
Chemical Property Profile of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one
Property Insights of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one
The XLogP value of 1.9365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluoro-5-nitrophenyl)ethan-1-one. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Fluoro-5-nitrophenyl)ethan-1-one. Following Lipinski's Rule of Five, 1-(2-Fluoro-5-nitrophenyl)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-(2-Fluoro-5-nitrophenyl)ethan-1-one?
The CAS number of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one is 57044-25-4.
What is the molecular formula of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one?
The molecular formula of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one is C8H6FNO3.
What is the molecular weight of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one?
The molecular weight of 1-(2-Fluoro-5-nitrophenyl)ethan-1-one is 183.03 g/mol.
Where can I buy 1-(2-Fluoro-5-nitrophenyl)ethan-1-one?
You can request a quote for 1-(2-Fluoro-5-nitrophenyl)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-(2-Fluoro-5-nitrophenyl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Fluoro-5-nitrophenyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.