4'-Fluoro-3-nitrobenzanilide
TL;DR: 4'-Fluoro-3-nitrobenzanilide (CAS 33489-69-9) is a chemical compound with molecular formula C13H9FN2O3 and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-3-nitrobenzamide
Also Known As: N-(4-fluorophenyl)-3-nitrobenzamide, 3-Nitro-N-(4-fluorophenyl)benzamide, 4'-FLUORO-3-NITROBENZANILIDE, N-(4-fluorophenyl)-3-nitro-benzamide, N-(4-fluorophenyl)(3-nitrophenyl)carboxamide
| Molecular Formula | C13H9FN2O3 |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.05972 |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 33489-69-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)F |
| InChIKey | YPRHMRVPFAHCJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Fluoro-3-nitrobenzanilide (CAS 33489-69-9), with molecular formula C13H9FN2O3 and molecular weight 260.06 g/mol. IUPAC: N-(4-fluorophenyl)-3-nitrobenzamide.
Chemical Property Profile of 4'-Fluoro-3-nitrobenzanilide
Property Insights of 4'-Fluoro-3-nitrobenzanilide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Fluoro-3-nitrobenzanilide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Fluoro-3-nitrobenzanilide. Following Lipinski's Rule of Five, 4'-Fluoro-3-nitrobenzanilide has 1 hydrogen bond donor(s) and 4 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 4'-Fluoro-3-nitrobenzanilide?
The CAS number of 4'-Fluoro-3-nitrobenzanilide is 33489-69-9.
What is the molecular formula of 4'-Fluoro-3-nitrobenzanilide?
The molecular formula of 4'-Fluoro-3-nitrobenzanilide is C13H9FN2O3.
What is the molecular weight of 4'-Fluoro-3-nitrobenzanilide?
The molecular weight of 4'-Fluoro-3-nitrobenzanilide is 260.06 g/mol.
Where can I buy 4'-Fluoro-3-nitrobenzanilide?
You can request a quote for 4'-Fluoro-3-nitrobenzanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Fluoro-3-nitrobenzanilide?
Yes, KEHONG BIO provides custom synthesis services for 4'-Fluoro-3-nitrobenzanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.