1,2,3,4-Tetrahydro-4-[2-[(1,3-Dicarboxypropyl)Imino]Ethylidene]Pyridine-2,6-Dicarboxylic Acid
[CAS# 1047-87-6]

Identification

• Name: 1,2,3,4-Tetrahydro-4-[2-[(1,3-Dicarboxypropyl)Imino]Ethylidene]Pyridine-2,6-Dicarboxylic Acid
• Synonyms: (2S)-4-[(E)-2-[[(1S)-1-Carboxy-4-Hydroxy-4-Oxo-Butyl]Amino]Vinyl]-2,3-Dihydropyridine-2,6-Dicarboxylic Acid; (2S)-4-[(E)-2-[[(1S)-1-Carboxy-4-Hydroxy-4-Oxobutyl]Amino]Vinyl]-2,3-Dihydropyridine-2,6-Dicarboxylic Acid; (2S)-4-[(E)-2-[[(1S)-1-Carboxy-4-Hydroxy-4-Keto-Butyl]Amino]Vinyl]-2,3-Dihydropyridine-2,6-Dicarboxylic Acid
• Molecular Formula: C₁₄H₁₆N₂O₈
• Molecular Weight: 340.29
• CAS Registry Number: 1047-87-6
• SMILES: [C@H](N/C=C/C1=CC(=N[C@@H](C1)C(O)=O)C(O)=O)(CCC(O)=O)C(O)=O
• InChI: 1S/C14H16N2O8/c17-11(18)2-1-8(12(19)20)15-4-3-7-5-9(13(21)22)16-10(6-7)14(23)24/h3-5,8,10,15H,1-2,6H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)/b4-3+/t8-,10-/m0/s1
• InChIKey: HWOAHVAPMFFSAN-PVXSWLFQSA-N

Properties

• Density: 1.567g/cm³ (Cal.)
• Boiling point: 706.982°C at 760 mmHg (Cal.)
• Flash point: 381.369°C (Cal.)