2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid
TL;DR: 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid (CAS 114829-12-8) is a chemical compound with molecular formula C10H10F3NO2 and molecular weight 233.06636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4,4,4-trifluoro-3-phenylbutanoic acid
Also Known As: 2-amino-4,4,4-trifluoro-3-phenylbutanoic acid, beta-(Trifluoromethyl)phenylalanine, ?-(Trifluoromethyl)phenylalanine, (2S)-2-amino-4,4,4-trifluoro-3-phenylbutanoic acid, 2-amino-3-phenyl-4,4,4-trifluorobutyric acid
Technical Specifications
| Molecular Formula | C10H10F3NO2 |
| Molecular Weight | 233.06636 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06636 Da |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
| SMILES | C1=CC=C(C=C1)C(C(C(=O)O)N)C(F)(F)F |
| InChIKey | HCFBWJOBUKKGCG-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid
Property Insights of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid
The XLogP value of -0.5 indicates that 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid. Following Lipinski's Rule of Five, 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid has 2 hydrogen bond donor(s) and 6 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-4,4,4-trifluoro-3-phenylbutanoic acid?
The CAS number of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid is 114829-12-8.
What is the molecular formula of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid?
The molecular formula of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid is C10H10F3NO2.
What is the molecular weight of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid?
The molecular weight of 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid is 233.06636 g/mol.
Where can I buy 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid?
You can request a quote for 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Amino-4,4,4-trifluoro-3-phenylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.