N-(2-Carboxyethyl)-N-[2-(2-Heptyl-4,5-Dihydro-1H-Imidazol-1-Yl)Ethyl]-beta-Alanine
[CAS# 69856-01-5]

Identification

• Name: N-(2-Carboxyethyl)-N-[2-(2-Heptyl-4,5-Dihydro-1H-Imidazol-1-Yl)Ethyl]-beta-Alanine
• Synonyms: 3-[2-Carboxyethyl-[2-(2-Heptyl-4,5-Dihydroimidazol-1-Yl)Ethyl]Amino]Propionic Acid; 1-(N,N-Bis(Carboxyethyl)Aminoethyl)-2-Heptyl-2-Imidazoline
• Molecular Formula: C₁₈H₃₃N₃O₄
• Molecular Weight: 355.48
• CAS Registry Number: 69856-01-5
• EINECS: 274-162-8
• SMILES: C(C1=NCCN1CCN(CCC(=O)O)CCC(=O)O)CCCCCC
• InChI: 1S/C18H33N3O4/c1-2-3-4-5-6-7-16-19-10-13-21(16)15-14-20(11-8-17(22)23)12-9-18(24)25/h2-15H2,1H3,(H,22,23)(H,24,25)
• InChIKey: VXWCUMLZBRJYFU-UHFFFAOYSA-N

Properties

• Density: 1.153g/cm³ (Cal.)
• Boiling point: 565.598°C at 760 mmHg (Cal.)
• Flash point: 295.863°C (Cal.)