4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid
TL;DR: 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid (CAS 857760-67-9) is a chemical compound with molecular formula C10H9NO5 and molecular weight 223.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid
Also Known As: 4-(2-amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid, 2-amino-3 -hydroxy-benzoyl pyruvic acid, 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoate, J2.756.639A, 2-Amino-3-hydroxy-I+-,I3-dioxobenzenebutanoic acid
| Molecular Formula | C10H9NO5 |
|---|---|
| Molecular Weight | 223.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.04807 |
| Heavy Atoms | 16 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 857760-67-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)O)N)C(=O)CC(=O)C(=O)O |
| InChIKey | YCJNYHCCOXVYAF-UHFFFAOYSA-N |
Product Overview
4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid (CAS 857760-67-9), with molecular formula C10H9NO5 and molecular weight 223.05 g/mol. IUPAC: 4-(2-amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid.
Chemical Property Profile of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid
Property Insights of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid. Following Lipinski's Rule of Five, 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid has 3 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 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid?
The CAS number of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid is 857760-67-9.
What is the molecular formula of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid?
The molecular formula of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid is C10H9NO5.
What is the molecular weight of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid?
The molecular weight of 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid is 223.05 g/mol.
Where can I buy 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid?
You can request a quote for 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Amino-3-hydroxyphenyl)-2,4-dioxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.