4-Amino-alpha-oxobenzeneacetic acid
TL;DR: 4-Amino-alpha-oxobenzeneacetic acid (CAS 15535-99-6) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminophenyl)-2-oxoacetic acid
Also Known As: 2-(4-aminophenyl)-2-oxoacetic acid, 4-Aminobenzene-(2'-oxoacetic acid), 4-Amino-alpha-oxobenzeneacetic acid, alpha-Oxo-4-aminobenzeneacetic acid, 2-(4-aminophenyl)-2-oxo-acetic Acid
| Molecular Formula | C8H7NO3 |
|---|---|
| Molecular Weight | 165.04 g/mol |
| LogP | 0.5361 |
| Topological Polar Surface Area | 80.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.04259 |
| Heavy Atoms | 12 |
| Complexity | 315.57977 |
Chemical Identifiers
| CAS Number | 15535-99-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C(=O)O)N |
Product Overview
4-Amino-alpha-oxobenzeneacetic acid (CAS 15535-99-6), with molecular formula C8H7NO3 and molecular weight 165.04 g/mol. IUPAC: 2-(4-aminophenyl)-2-oxoacetic acid.
Chemical Property Profile of 4-Amino-alpha-oxobenzeneacetic acid
Property Insights of 4-Amino-alpha-oxobenzeneacetic acid
The XLogP value of 0.5361 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-alpha-oxobenzeneacetic acid. The TPSA of 80.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-alpha-oxobenzeneacetic acid. Following Lipinski's Rule of Five, 4-Amino-alpha-oxobenzeneacetic acid has 2 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 4-Amino-alpha-oxobenzeneacetic acid?
The CAS number of 4-Amino-alpha-oxobenzeneacetic acid is 15535-99-6.
What is the molecular formula of 4-Amino-alpha-oxobenzeneacetic acid?
The molecular formula of 4-Amino-alpha-oxobenzeneacetic acid is C8H7NO3.
What is the molecular weight of 4-Amino-alpha-oxobenzeneacetic acid?
The molecular weight of 4-Amino-alpha-oxobenzeneacetic acid is 165.04 g/mol.
Where can I buy 4-Amino-alpha-oxobenzeneacetic acid?
You can request a quote for 4-Amino-alpha-oxobenzeneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-alpha-oxobenzeneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-alpha-oxobenzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.