4-(Phosphonoacetyl)-L-alpha-Aminobutyrate
[CAS# 74317-96-7]

Identification

• Name: 4-(Phosphonoacetyl)-L-alpha-Aminobutyrate
• Synonyms: (2S)-2-Amino-5-Oxo-6-Phosphono-Hexanoic Acid; (2S)-2-Amino-5-Keto-6-Phosphono-Hexanoic Acid; 4-(Phosphonoacetyl)-L-Alpha-Aminobutyrate
• Molecular Formula: C₆H₁₂NO₆P
• Molecular Weight: 225.14
• CAS Registry Number: 74317-96-7
• SMILES: [C@H](C(=O)O)(N)CCC(C[P](=O)(O)O)=O
• InChI: 1S/C6H12NO6P/c7-5(6(9)10)2-1-4(8)3-14(11,12)13/h5H,1-3,7H2,(H,9,10)(H2,11,12,13)/t5-/m0/s1
• InChIKey: LNRRYRBFQHQQKG-YFKPBYRVSA-N

Properties

• Density: 1.58g/cm³ (Cal.)
• Boiling point: 555.345°C at 760 mmHg (Cal.)
• Flash point: 289.663°C (Cal.)