(3E)-2-Amino-4-Methyl-5-Phosphono-3-Pentenoic Acid 1-Ethyl Ester
[CAS# 127910-32-1]

Identification

• Name: (3E)-2-Amino-4-Methyl-5-Phosphono-3-Pentenoic Acid 1-Ethyl Ester
• Synonyms: (4-Amino-5-Ethoxy-2-Methyl-5-Oxopent-2-Enyl)Phosphonic Acid; [(E)-4-Amino-5-Ethoxy-2-Methyl-5-Oxo-Pent-2-Enyl]Phosphonic Acid; (4-Amino-5-Ethoxy-2-Methyl-5-Oxo-Pent-2-Enyl)Phosphonic Acid
• Molecular Formula: C₈H₁₆NO₅P
• Molecular Weight: 237.19
• CAS Registry Number: 127910-32-1
• SMILES: C([P](=O)(O)O)\C(=C\C(N)C(=O)OCC)C
• InChI: 1S/C8H16NO5P/c1-3-14-8(10)7(9)4-6(2)5-15(11,12)13/h4,7H,3,5,9H2,1-2H3,(H2,11,12,13)/b6-4+
• InChIKey: OKDOWCKDTWNRCB-GQCTYLIASA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 434.099°C at 760 mmHg (Cal.)
• Flash point: 216.336°C (Cal.)
• solubility: Soluble to 100 mM in water