![4-[(4-Nitrophenyl)Amino]Benzoic Acid structure](/static/products/1612/16124-69-9.webp)
4-[(4-Nitrophenyl)Amino]Benzoic Acid
TL;DR: 4-[(4-Nitrophenyl)Amino]Benzoic Acid (CAS 16124-69-9) is a chemical compound with molecular formula C13H10N2O4 and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitroanilino)benzoic acid
Also Known As: 4-(4-nitroanilino)benzoic acid, 4-{4-nitroanilino}benzoic acid, 4-[(4-Nitrophenyl)Amino]Benzoic Acid, benzoic acid, 4-(4-nitroanilino)-, 4'-Nitro-diphenylamin-4-carbonsaeure
| Molecular Formula | C13H10N2O4 |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.06406 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 16124-69-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | SPWISUSNVKQQAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(4-Nitrophenyl)Amino]Benzoic Acid (CAS 16124-69-9), with molecular formula C13H10N2O4 and molecular weight 258.06 g/mol. IUPAC: 4-(4-nitroanilino)benzoic acid.
Chemical Property Profile of 4-[(4-Nitrophenyl)Amino]Benzoic Acid
Property Insights of 4-[(4-Nitrophenyl)Amino]Benzoic Acid
The XLogP value of 3.4 indicates that 4-[(4-Nitrophenyl)Amino]Benzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-Nitrophenyl)Amino]Benzoic Acid. Following Lipinski's Rule of Five, 4-[(4-Nitrophenyl)Amino]Benzoic Acid has 2 hydrogen bond donor(s) and 5 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-[(4-Nitrophenyl)Amino]Benzoic Acid?
The CAS number of 4-[(4-Nitrophenyl)Amino]Benzoic Acid is 16124-69-9.
What is the molecular formula of 4-[(4-Nitrophenyl)Amino]Benzoic Acid?
The molecular formula of 4-[(4-Nitrophenyl)Amino]Benzoic Acid is C13H10N2O4.
What is the molecular weight of 4-[(4-Nitrophenyl)Amino]Benzoic Acid?
The molecular weight of 4-[(4-Nitrophenyl)Amino]Benzoic Acid is 258.06 g/mol.
Where can I buy 4-[(4-Nitrophenyl)Amino]Benzoic Acid?
You can request a quote for 4-[(4-Nitrophenyl)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 4-[(4-Nitrophenyl)Amino]Benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Nitrophenyl)Amino]Benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.