2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid
TL;DR: 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid (CAS 1026755-44-1) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid
Also Known As: TimTec1_000919, 2-amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid, BRD-A92997230-001-01-3
Technical Specifications
| Molecular Formula | C12H15NO4 |
| Molecular Weight | 237.10011 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 237.10011 Da |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
| SMILES | CCOC1=CC=C(C=C1)C(=O)CC(C(=O)O)N |
| InChIKey | QBBNWCTXXOGLFR-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid
Property Insights of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid
The XLogP value of -1.7 indicates that 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid?
The CAS number of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid is 1026755-44-1.
What is the molecular formula of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid?
The molecular formula of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid is C12H15NO4.
What is the molecular weight of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid?
The molecular weight of 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid is 237.10011 g/mol.
Where can I buy 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid?
You can request a quote for 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Amino-4-(4-ethoxyphenyl)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.