N-(2-Carboxyethyl)-N-nitro-beta-alanine
[CAS# 99-69-4]

Identification

• Name: N-(2-Carboxyethyl)-N-nitro-beta-alanine
• Synonyms: 3-(2-Carboxyethyl-Nitro-Amino)Propanoic Acid; 3-(2-Carboxyethyl-Nitro-Amino)Propionic Acid; 3,3'-Nitroiminodipropionic Acid
• Molecular Formula: C₆H₁₀N₂O₆
• Molecular Weight: 206.15
• CAS Registry Number: 99-69-4
• EINECS: 202-779-4
• SMILES: C(N([N+]([O-])=O)CCC(O)=O)CC(O)=O
• InChI: 1S/C6H10N2O6/c9-5(10)1-3-7(8(13)14)4-2-6(11)12/h1-4H2,(H,9,10)(H,11,12)
• InChIKey: MXPYFZODOSRODU-UHFFFAOYSA-N

Properties

• Density: 1.506g/cm³ (Cal.)
• Boiling point: 548.756°C at 760 mmHg (Cal.)
• Flash point: 285.678°C (Cal.)