2-(2-Methoxyanilino)-5-nitrobenzoic acid
TL;DR: 2-(2-Methoxyanilino)-5-nitrobenzoic acid (CAS 5291-56-5) 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.
2-(2-methoxyanilino)-5-nitrobenzoic acid
Also Known As: 2-(2-Methoxyanilino)-5-nitrobenzoic acid, 2-(2-Methoxyphenylamino)-5-nitrobenzoic acid, Benzoic acid, 2-[(2-methoxyphenyl)amino]-5-nitro-, 2-(2-Methoxyanilino)-5-nitrobenzoic acid #, 2-[(2-methoxyphenyl)amino]-5-nitrobenzoic acid
| Molecular Formula | C14H12N2O5 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.07462 |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 5291-56-5 |
|---|---|
| SMILES | COC1=CC=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O |
| InChIKey | WZJZEMMMZTVEAK-UHFFFAOYSA-N |
Product Overview
2-(2-Methoxyanilino)-5-nitrobenzoic acid (CAS 5291-56-5), with molecular formula C14H12N2O5 and molecular weight 288.07 g/mol. IUPAC: 2-(2-methoxyanilino)-5-nitrobenzoic acid.
Chemical Property Profile of 2-(2-Methoxyanilino)-5-nitrobenzoic acid
Property Insights of 2-(2-Methoxyanilino)-5-nitrobenzoic acid
The XLogP value of 4.5 indicates that 2-(2-Methoxyanilino)-5-nitrobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methoxyanilino)-5-nitrobenzoic acid. Following Lipinski's Rule of Five, 2-(2-Methoxyanilino)-5-nitrobenzoic acid has 2 hydrogen bond donor(s) and 6 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-(2-Methoxyanilino)-5-nitrobenzoic acid?
The CAS number of 2-(2-Methoxyanilino)-5-nitrobenzoic acid is 5291-56-5.
What is the molecular formula of 2-(2-Methoxyanilino)-5-nitrobenzoic acid?
The molecular formula of 2-(2-Methoxyanilino)-5-nitrobenzoic acid is C14H12N2O5.
What is the molecular weight of 2-(2-Methoxyanilino)-5-nitrobenzoic acid?
The molecular weight of 2-(2-Methoxyanilino)-5-nitrobenzoic acid is 288.07 g/mol.
Where can I buy 2-(2-Methoxyanilino)-5-nitrobenzoic acid?
You can request a quote for 2-(2-Methoxyanilino)-5-nitrobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methoxyanilino)-5-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methoxyanilino)-5-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.