(2S)-2-(diphosphonomethyl-methyl-amino)butanedioic acid
[CAS# 94200-64-3]

Identification

• Name: (2S)-2-(diphosphonomethyl-methyl-amino)butanedioic acid
• Synonyms: N-[bis(phosphono)methyl]-N-methyl-L-aspartic acid
• Molecular Formula: C₆H₁₃NO₁₀P₂
• Molecular Weight: 321.12
• CAS Registry Number: 94200-64-3
• EINECS: 303-542-9
• SMILES: CN(C(P(=O)(O)O)P(O)(O)=O)[C@@H](CC(O)=O)C(O)=O
• InChI: 1S/C6H13NO10P2/c1-7(3(5(10)11)2-4(8)9)6(18(12,13)14)19(15,16)17/h3,6H,2H2,1H3,(H,8,9)(H,10,11)(H2,12,13,14)(H2,15,16,17)/t3-/m0/s1
• InChIKey: VMSJBJKSLZOBJT-VKHMYHEASA-N

Properties

• Density: 1.968g/cm³ (Cal.)
• Boiling point: 654.558°C at 760 mmHg (Cal.)
• Flash point: 349.664°C (Cal.)