N-(4-fluorophenyl)-4-nitroaniline
TL;DR: N-(4-fluorophenyl)-4-nitroaniline (CAS 330-89-2) is a chemical compound with molecular formula C12H9FN2O2 and molecular weight 232.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-4-nitroaniline
Also Known As: 4-Fluoro-4'-nitrodiphenylamine, N-(4-fluorophenyl)-4-nitroaniline, 4-Fluoro-N-(4-nitrophenyl)aniline, Ethyl 2-aminooxazole-4-carboxylate, N-(4-fluorophenyl)-4-nitro-aniline
| Molecular Formula | C12H9FN2O2 |
|---|---|
| Molecular Weight | 232.06 g/mol |
| LogP | 3.4775 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0648 |
| Heavy Atoms | 17 |
| Complexity | 523.20685 |
Chemical Identifiers
| CAS Number | 330-89-2 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
N-(4-fluorophenyl)-4-nitroaniline (CAS 330-89-2), with molecular formula C12H9FN2O2 and molecular weight 232.06 g/mol. IUPAC: N-(4-fluorophenyl)-4-nitroaniline.
Chemical Property Profile of N-(4-fluorophenyl)-4-nitroaniline
Property Insights of N-(4-fluorophenyl)-4-nitroaniline
The XLogP value of 3.4775 indicates that N-(4-fluorophenyl)-4-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.17 Ų, N-(4-fluorophenyl)-4-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-4-nitroaniline 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 N-(4-fluorophenyl)-4-nitroaniline?
The CAS number of N-(4-fluorophenyl)-4-nitroaniline is 330-89-2.
What is the molecular formula of N-(4-fluorophenyl)-4-nitroaniline?
The molecular formula of N-(4-fluorophenyl)-4-nitroaniline is C12H9FN2O2.
What is the molecular weight of N-(4-fluorophenyl)-4-nitroaniline?
The molecular weight of N-(4-fluorophenyl)-4-nitroaniline is 232.06 g/mol.
Where can I buy N-(4-fluorophenyl)-4-nitroaniline?
You can request a quote for N-(4-fluorophenyl)-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluorophenyl)-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.