(2S)-2-(3-Methylbutanoylamino)Pentanedioic Acid
[CAS# 80154-63-8]

Identification

• Name: (2S)-2-(3-Methylbutanoylamino)Pentanedioic Acid
• Synonyms: (2S)-2-[(3-Methyl-1-Oxobutyl)Amino]Pentanedioic Acid; (2S)-2-(Isovalerylamino)Glutaric Acid; L-Glutamic Acid, N-(3-Methyl-1-Oxobutyl)-
• Molecular Formula: C₁₀H₁₇NO₅
• Molecular Weight: 231.25
• CAS Registry Number: 80154-63-8
• SMILES: [C@H](C(=O)O)(NC(CC(C)C)=O)CCC(=O)O
• InChI: 1S/C10H17NO5/c1-6(2)5-8(12)11-7(10(15)16)3-4-9(13)14/h6-7H,3-5H2,1-2H3,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1
• InChIKey: HCVIJONZMYVLAW-ZETCQYMHSA-N

Properties

• Density: 1.22g/cm³ (Cal.)
• Boiling point: 484.849°C at 760 mmHg (Cal.)
• Flash point: 247.028°C (Cal.)