Alanyl-phenylalanyl-lysine fluoromethane
[CAS# 107573-17-1]

Identification

• Name: Alanyl-phenylalanyl-lysine fluoromethane
• Synonyms: (2S)-6-Amino-2-[[(2S)-2-[[(2S)-2-Aminopropanoyl]Amino]-3-Phenyl-Propanoyl]Amino]Hexanoic Acid; Fluoromethane; (2S)-6-Amino-2-[[(2S)-2-[[(2S)-2-Amino-1-Oxopropyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]Hexanoic Acid; Fluoromethane; (2S)-2-[[(2S)-2-(Alanylamino)-3-Phenyl-Propanoyl]Amino]-6-Amino-Hexanoic Acid; Fluoromethane
• Molecular Formula: C₁₉H₃₁FN₄O₄
• Molecular Weight: 398.48
• CAS Registry Number: 107573-17-1
• SMILES: [C@@H](NC(=O)[C@@H](N)C)(C(=O)N[C@H](C(=O)O)CCCCN)CC1=CC=CC=C1.CF
• InChI: 1S/C18H28N4O4.CH3F/c1-12(20)16(23)22-15(11-13-7-3-2-4-8-13)17(24)21-14(18(25)26)9-5-6-10-19;1-2/h2-4,7-8,12,14-15H,5-6,9-11,19-20H2,1H3,(H,21,24)(H,22,23)(H,25,26);1H3/t12-,14-,15-;/m0./s1
• InChIKey: DEXOLHUUTGWNNJ-XJPBFQKESA-N

Properties

• Boiling point: 705.5°C at 760 mmHg (Cal.)
• Flash point: 380.5°C (Cal.)