2-(1,3-Dioxo-1,3-Dihydro-2H-Isoindol-2-Yl)-3-Methylpentanoic Acid
[CAS# 19506-84-4]

Identification

• Name: 2-(1,3-Dioxo-1,3-Dihydro-2H-Isoindol-2-Yl)-3-Methylpentanoic Acid
• Synonyms: (2S,3R)-2-(1,3-Dioxoisoindolin-2-Yl)-3-Methyl-Pentanoate; (2S,3R)-2-(1,3-Dioxo-2-Isoindolinyl)-3-Methylpentanoate; (2S,3R)-2-(1,3-Diketoisoindolin-2-Yl)-3-Methyl-Valerate
• Molecular Formula: C₁₄H₁₄NO₄
• Molecular Weight: 260.27
• CAS Registry Number: 19506-84-4
• SMILES: [C@H](N1C(=O)C2=C(C1=O)C=CC=C2)([C@@H](CC)C)C([O-])=O
• InChI: 1S/C14H15NO4/c1-3-8(2)11(14(18)19)15-12(16)9-6-4-5-7-10(9)13(15)17/h4-8,11H,3H2,1-2H3,(H,18,19)/p-1/t8-,11+/m1/s1
• InChIKey: RUUWUOYPIXTMLF-KCJUWKMLSA-M

Properties

• Boiling point: 426.436°C at 760 mmHg (Cal.)
• Flash point: 211.701°C (Cal.)