2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid
TL;DR: 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid (CAS 154461-69-5) is a chemical compound with molecular formula C12H12N2O4 and molecular weight 248.07971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-(3-oxo-5-phenyl-1,2-oxazol-4-yl)propanoic acid
Also Known As: Appa-(R,S), 2-Amino-3-(3-hydroxy-5-phenylisoxazol-4-yl)propionic acid, 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid, alpha-amino-3-hydroxy-5-phenyl-4-isoxazolepropionic acid, 2-Amino-3-(3-hydroxy-5-phenylisoxazole-4-yl)propionic acid
Technical Specifications
| Molecular Formula | C12H12N2O4 |
| Molecular Weight | 248.07971 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.07971 Da |
| Heavy Atoms | 18 |
| Complexity | 386.0 |
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)NO2)CC(C(=O)O)N |
| InChIKey | JCXLPVAAGYNKBT-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid
Property Insights of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid
The XLogP value of -2.0 indicates that 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid. Following Lipinski's Rule of Five, 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid has 3 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-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid?
The CAS number of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid is 154461-69-5.
What is the molecular formula of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid?
The molecular formula of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid is C12H12N2O4.
What is the molecular weight of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid?
The molecular weight of 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid is 248.07971 g/mol.
Where can I buy 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid?
You can request a quote for 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid?
Yes, CoreyChem provides custom synthesis services for 2-Amino-3-(3-hydroxy-5-phenyl-isoxazol-4-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.