L-Proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt

Base Information

• Chemical Name: L-Proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt
• CAS No.: 59749-27-8
• Molecular Formula: C12H12FNO3•H3N
• Molecular Weight: 254.29
• DSSTox Substance ID: DTXSID70208470
• Mol file: 59749-27-8.mol

Synonyms:N-(p-Fluorobenzyl)pyroglutamate d'ammonium [French];L-Proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt;1-((4-Fluorophenyl)methyl)-5-oxo-L-proline ammonium salt;N-(p-Fluorobenzyl)pyroglutamate d'ammonium;59749-27-8;C12H12FNO3.H3N;DTXSID70208470;C12-H12-F-N-O3.H3-N;LS-118940

Chemical Property of L-Proline, 1-((4-fluorophenyl)methyl)-5-oxo-, ammonium salt

Chemical Property:

• Vapor Pressure: 7.12E-10mmHg at 25°C
• Boiling Point: 476.2°Cat760mmHg
• Flash Point: 241.8°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 254.10667051
• Heavy Atom Count: 18
• Complexity: 307

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)N(C1C(=O)[O-])CC2=CC=C(C=C2)F.[NH4+]
• Isomeric SMILES: C1CC(=O)N([C@@H]1C(=O)[O-])CC2=CC=C(C=C2)F.[NH4+]