4-(4-Methoxyanilino)-3-nitrobenzoic acid
TL;DR: 4-(4-Methoxyanilino)-3-nitrobenzoic acid (CAS 148304-22-7) is a chemical compound with molecular formula C14H12N2O5 and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyanilino)-3-nitrobenzoic acid
Also Known As: 4-(4-methoxyanilino)-3-nitrobenzoic acid, 4-[(4-methoxyphenyl)amino]-3-nitrobenzoic acid, 4565AD, Benzoic acid, 4-[(4-methoxyphenyl)amino]-3-nitro-, 4-(4-methoxyanilino)-3-nitrobenzoicacid
| Molecular Formula | C14H12N2O5 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 3.0452 |
| Topological Polar Surface Area | 101.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.07462 |
| Heavy Atoms | 21 |
| Complexity | 682.2638 |
Chemical Identifiers
| CAS Number | 148304-22-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-] |
Product Overview
4-(4-Methoxyanilino)-3-nitrobenzoic acid (CAS 148304-22-7), with molecular formula C14H12N2O5 and molecular weight 288.07 g/mol. IUPAC: 4-(4-methoxyanilino)-3-nitrobenzoic acid.
Chemical Property Profile of 4-(4-Methoxyanilino)-3-nitrobenzoic acid
Property Insights of 4-(4-Methoxyanilino)-3-nitrobenzoic acid
The XLogP value of 3.0452 indicates that 4-(4-Methoxyanilino)-3-nitrobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxyanilino)-3-nitrobenzoic acid. Following Lipinski's Rule of Five, 4-(4-Methoxyanilino)-3-nitrobenzoic 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-Methoxyanilino)-3-nitrobenzoic acid?
The CAS number of 4-(4-Methoxyanilino)-3-nitrobenzoic acid is 148304-22-7.
What is the molecular formula of 4-(4-Methoxyanilino)-3-nitrobenzoic acid?
The molecular formula of 4-(4-Methoxyanilino)-3-nitrobenzoic acid is C14H12N2O5.
What is the molecular weight of 4-(4-Methoxyanilino)-3-nitrobenzoic acid?
The molecular weight of 4-(4-Methoxyanilino)-3-nitrobenzoic acid is 288.07 g/mol.
Where can I buy 4-(4-Methoxyanilino)-3-nitrobenzoic acid?
You can request a quote for 4-(4-Methoxyanilino)-3-nitrobenzoic 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-Methoxyanilino)-3-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxyanilino)-3-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.