5-Ethoxy-4-fluoro-2-nitroaniline
TL;DR: 5-Ethoxy-4-fluoro-2-nitroaniline (CAS 125163-13-5) is a chemical compound with molecular formula C8H9FN2O3 and molecular weight 200.05972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethoxy-4-fluoro-2-nitroaniline
Also Known As: 5-ethoxy-4-fluoro-2-nitroaniline, 5-ethoxy-4-fluoro-2-nitro-aniline, Benzenamine, 5-ethoxy-4-fluoro-2-nitro- (9CI), BENZENAMINE, 5-ETHOXY-4-FLUORO-2-NITRO-, BENZENAMINE,5-ETHOXY-4-FLUORO-2-NITRO
Technical Specifications
| Molecular Formula | C8H9FN2O3 |
| Molecular Weight | 200.05972 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 81.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.05972 Da |
| Heavy Atoms | 14 |
| Complexity | 209.0 |
| SMILES | CCOC1=C(C=C(C(=C1)N)[N+](=O)[O-])F |
| InChIKey | IXBTZWMWZZYTIT-UHFFFAOYSA-N |
Chemical Property Profile of 5-Ethoxy-4-fluoro-2-nitroaniline
Property Insights of 5-Ethoxy-4-fluoro-2-nitroaniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethoxy-4-fluoro-2-nitroaniline. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethoxy-4-fluoro-2-nitroaniline. Following Lipinski's Rule of Five, 5-Ethoxy-4-fluoro-2-nitroaniline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Ethoxy-4-fluoro-2-nitroaniline?
The CAS number of 5-Ethoxy-4-fluoro-2-nitroaniline is 125163-13-5.
What is the molecular formula of 5-Ethoxy-4-fluoro-2-nitroaniline?
The molecular formula of 5-Ethoxy-4-fluoro-2-nitroaniline is C8H9FN2O3.
What is the molecular weight of 5-Ethoxy-4-fluoro-2-nitroaniline?
The molecular weight of 5-Ethoxy-4-fluoro-2-nitroaniline is 200.05972 g/mol.
Where can I buy 5-Ethoxy-4-fluoro-2-nitroaniline?
You can request a quote for 5-Ethoxy-4-fluoro-2-nitroaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Ethoxy-4-fluoro-2-nitroaniline?
Yes, CoreyChem provides custom synthesis services for 5-Ethoxy-4-fluoro-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.