(S)-2-Amino-3-(2,4,5-trifluorophenyl)propanoic acid

Base Information

• Chemical Name: (S)-2-Amino-3-(2,4,5-trifluorophenyl)propanoic acid
• CAS No.: 749847-57-2
• Molecular Formula: C9H8F3NO2
• Molecular Weight: 219.16
• DSSTox Substance ID: DTXSID30376129
• Nikkaji Number: J1.410.328G
• Mol file: 749847-57-2.mol

Synonyms:749847-57-2;(S)-2-Amino-3-(2,4,5-trifluorophenyl)propanoic acid;L-2,4,5-Trifluorophenylalanine;2,4,5-Trifluoro-L-Phenylalanine;(2S)-2-amino-3-(2,4,5-trifluorophenyl)propanoic acid;2,4,5-Trifluorophenylalanine;SCHEMBL1818169;2,4,5-tri fluoro-phenylalanine;DTXSID30376129;MFCD06657675;AKOS015949895;DS-5192;CS-0186166;A50357;L-2,4,5-Trifluorophenylalanine (H-Phe(2,4,5-F3)-OH)

Chemical Property of (S)-2-Amino-3-(2,4,5-trifluorophenyl)propanoic acid

Chemical Property:

• Boiling Point: 304.1 °C at 760 mmHg
• PKA: 2.16±0.25(Predicted)
• Flash Point: 137.7 °C
• PSA: 63.32000
• Density: 1.46 g/cm³
• LogP: 1.75860
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 219.05071298
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

99%+, ^*data from raw suppliers

L-2,4,5-Trifluorophenylalanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1F)F)F)CC(C(=O)O)N
• Isomeric SMILES: C1=C(C(=CC(=C1F)F)F)C[C@@H](C(=O)O)N