TL;DR: (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid (CAS 1228569-82-1) is a chemical compound with molecular formula C9H8F3NO2 and molecular weight 219.05072 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid
Also Known As: (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid, (S)-2-(2-(Trifluoromethyl)phenyl)-Gly-OH, J3.695.339J, 2-amino-2-[2-(trifluoromethyl)phenyl]acetic Acid, (S)-AMINO-(2-TRIFLUOROMETHYL-PHENYL)-ACETIC ACID
| Molecular Formula | C9H8F3NO2 |
| Molecular Weight | 219.05072 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.05072 Da |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
| SMILES | C1=CC=C(C(=C1)[C@@H](C(=O)O)N)C(F)(F)F |
| InChIKey | WSMXFJGWNKBPHC-ZETCQYMHSA-N |
The XLogP value of -0.8 indicates that (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic 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 (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid. Following Lipinski's Rule of Five, (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid is 1228569-82-1.
The molecular formula of (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid is C9H8F3NO2.
The molecular weight of (2S)-2-amino-2-[2-(trifluoromethyl)phenyl]acetic acid is 219.05072 g/mol.
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