4-(4-Methoxy-2-nitrophenyl)benzoic acid
TL;DR: 4-(4-Methoxy-2-nitrophenyl)benzoic acid (CAS 5728-49-4) is a chemical compound with molecular formula C14H11NO5 and molecular weight 273.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxy-2-nitrophenyl)benzoic acid
Also Known As: 4-(4-methoxy-2-nitrophenyl)benzoic acid, 2'-nitro-4'-methoxy[1,1'-biphenyl]-4-carboxylic acid, AA-516/12432471, 4'-methoxy-2'-nitro-[1,1'-biphenyl]-4-carboxylic acid
| Molecular Formula | C14H11NO5 |
|---|---|
| Molecular Weight | 273.06 g/mol |
| LogP | 2.9686 |
| Topological Polar Surface Area | 89.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.06372 |
| Heavy Atoms | 20 |
| Complexity | 663.7645 |
Chemical Identifiers
| CAS Number | 5728-49-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=CC=C(C=C2)C(=O)O)[N+](=O)[O-] |
Product Overview
4-(4-Methoxy-2-nitrophenyl)benzoic acid (CAS 5728-49-4), with molecular formula C14H11NO5 and molecular weight 273.06 g/mol. IUPAC: 4-(4-methoxy-2-nitrophenyl)benzoic acid.
Chemical Property Profile of 4-(4-Methoxy-2-nitrophenyl)benzoic acid
Property Insights of 4-(4-Methoxy-2-nitrophenyl)benzoic acid
The XLogP value of 2.9686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxy-2-nitrophenyl)benzoic acid. The TPSA of 89.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxy-2-nitrophenyl)benzoic acid. Following Lipinski's Rule of Five, 4-(4-Methoxy-2-nitrophenyl)benzoic acid 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-(4-Methoxy-2-nitrophenyl)benzoic acid?
The CAS number of 4-(4-Methoxy-2-nitrophenyl)benzoic acid is 5728-49-4.
What is the molecular formula of 4-(4-Methoxy-2-nitrophenyl)benzoic acid?
The molecular formula of 4-(4-Methoxy-2-nitrophenyl)benzoic acid is C14H11NO5.
What is the molecular weight of 4-(4-Methoxy-2-nitrophenyl)benzoic acid?
The molecular weight of 4-(4-Methoxy-2-nitrophenyl)benzoic acid is 273.06 g/mol.
Where can I buy 4-(4-Methoxy-2-nitrophenyl)benzoic acid?
You can request a quote for 4-(4-Methoxy-2-nitrophenyl)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-Methoxy-2-nitrophenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxy-2-nitrophenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.