![2-[(4-Fluorophenyl)amino]benzoic acid structure](/static/products/5460/54-60-4.webp)
2-[(4-Fluorophenyl)amino]benzoic acid
TL;DR: 2-[(4-Fluorophenyl)amino]benzoic acid (CAS 54-60-4) is a chemical compound with molecular formula C13H10FNO2 and molecular weight 231.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluoroanilino)benzoic acid
Also Known As: N-(4-Fluorophenyl)anthranilic acid, 2-[(4-fluorophenyl)amino]benzoic acid, 2-(4-Fluoroanilino)benzoic acid, 2-((4-Fluorophenyl)amino)benzoic acid, N-(p-Fluorophenyl)anthranilic acid
| Molecular Formula | C13H10FNO2 |
|---|---|
| Molecular Weight | 231.07 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.06955 |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 54-60-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)F |
| InChIKey | YQDLBCADRCGKQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-Fluorophenyl)amino]benzoic acid (CAS 54-60-4), with molecular formula C13H10FNO2 and molecular weight 231.07 g/mol. IUPAC: 2-(4-fluoroanilino)benzoic acid.
Chemical Property Profile of 2-[(4-Fluorophenyl)amino]benzoic acid
Property Insights of 2-[(4-Fluorophenyl)amino]benzoic acid
The XLogP value of 4.5 indicates that 2-[(4-Fluorophenyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 2-[(4-Fluorophenyl)amino]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)amino]benzoic acid has 2 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 2-[(4-Fluorophenyl)amino]benzoic acid?
The CAS number of 2-[(4-Fluorophenyl)amino]benzoic acid is 54-60-4.
What is the molecular formula of 2-[(4-Fluorophenyl)amino]benzoic acid?
The molecular formula of 2-[(4-Fluorophenyl)amino]benzoic acid is C13H10FNO2.
What is the molecular weight of 2-[(4-Fluorophenyl)amino]benzoic acid?
The molecular weight of 2-[(4-Fluorophenyl)amino]benzoic acid is 231.07 g/mol.
Where can I buy 2-[(4-Fluorophenyl)amino]benzoic acid?
You can request a quote for 2-[(4-Fluorophenyl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Fluorophenyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Fluorophenyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.