Nopaline
[CAS# 22350-70-5]

Identification

• Name: Nopaline
• Synonyms: (2S)-2-[[(1R)-1-Carboxy-4-Guanidino-Butyl]Amino]Pentanedioic Acid; (2S)-2-[[(1R)-1-Carboxy-4-Guanidinobutyl]Amino]Pentanedioic Acid; (2S)-2-[[(1R)-1-Carboxy-4-Guanidino-Butyl]Amino]Glutaric Acid
• Molecular Formula: C₁₁H₂₀N₄O₆
• Molecular Weight: 304.30
• CAS Registry Number: 22350-70-5
• SMILES: [C@@H](N[C@@H](CCC(O)=O)C(O)=O)(CCCN=C(N)N)C(O)=O
• InChI: 1S/C11H20N4O6/c12-11(13)14-5-1-2-6(9(18)19)15-7(10(20)21)3-4-8(16)17/h6-7,15H,1-5H2,(H,16,17)(H,18,19)(H,20,21)(H4,12,13,14)/t6-,7+/m1/s1
• InChIKey: LMKYZBGVKHTLTN-RQJHMYQMSA-N

Properties

• Density: 1.549g/cm³ (Cal.)
• Boiling point: 629.17°C at 760 mmHg (Cal.)
• Flash point: 334.31°C (Cal.)