Sodium 4-aminobenzoate
TL;DR: Sodium 4-aminobenzoate (CAS 54287-22-8) is a chemical compound with molecular formula C7H6NNaO2 and molecular weight 159.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 4-aminobenzoate
Also Known As: Sodium 4-aminobenzoate, Aminobenzoate sodium, Antergyl, Sodium p-aminobenzoate, Sodium aminobenzoate
| Molecular Formula | C7H6NNaO2 |
|---|---|
| Molecular Weight | 159.03 g/mol |
| LogP | -3.3637 |
| Topological Polar Surface Area | 66.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.02962 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 54287-22-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)[O-])N.[Na+] |
| InChIKey | XETSAYZRDCRPJY-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sodium 4-aminobenzoate (CAS 54287-22-8), with molecular formula C7H6NNaO2 and molecular weight 159.03 g/mol. IUPAC: sodium 4-aminobenzoate.
Chemical Property Profile of Sodium 4-aminobenzoate
Property Insights of Sodium 4-aminobenzoate
The XLogP value of -3.3637 indicates that Sodium 4-aminobenzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium 4-aminobenzoate. Following Lipinski's Rule of Five, Sodium 4-aminobenzoate has 1 hydrogen bond donor(s) and 3 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 Sodium 4-aminobenzoate?
The CAS number of Sodium 4-aminobenzoate is 54287-22-8.
What is the molecular formula of Sodium 4-aminobenzoate?
The molecular formula of Sodium 4-aminobenzoate is C7H6NNaO2.
What is the molecular weight of Sodium 4-aminobenzoate?
The molecular weight of Sodium 4-aminobenzoate is 159.03 g/mol.
Where can I buy Sodium 4-aminobenzoate?
You can request a quote for Sodium 4-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium 4-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Sodium 4-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.