(2S)-2,6-diaminohexanoic acid, 2-propylpentanoate
[CAS# 86827-89-6]

Identification

• Name: (2S)-2,6-diaminohexanoic acid, 2-propylpentanoate
• Synonyms: 2-Propylpentanoate-L-lysine; L-Lysine valproate; Lysine valproate
• Molecular Formula: C₁₄H₂₉N₂O₄
• Molecular Weight: 289.39
• CAS Registry Number: 86827-89-6
• SMILES: [O-]C(=O)C(CCC)CCC.O=C(O)[C@@H](N)CCCCN
• InChI: 1S/C8H16O2.C6H14N2O2/c1-3-5-7(6-4-2)8(9)10;7-4-2-1-3-5(8)6(9)10/h7H,3-6H2,1-2H3,(H,9,10);5H,1-4,7-8H2,(H,9,10)/p-1/t;5-/m.0/s1
• InChIKey: AGNQIKMTXLWSMI-ZSCHJXSPSA-M

Properties

• Boiling point: 220°C at 760 mmHg (Cal.)
• Flash point: 116.6°C (Cal.)