(2S)-5-Amino-2-[(3,4-Dihydroxyphenyl)-Methylamino]-5-Oxopentanoic Acid
[CAS# 76500-09-9]

Identification

• Name: (2S)-5-Amino-2-[(3,4-Dihydroxyphenyl)-Methylamino]-5-Oxopentanoic Acid
• Synonyms: (2S)-5-Amino-2-[(3,4-Dihydroxyphenyl)-Methyl-Amino]-5-Oxo-Pentanoic Acid; (2S)-5-Amino-2-[(3,4-Dihydroxyphenyl)-Methyl-Amino]-5-Keto-Valeric Acid; L-Glutamine, N-(3,4-Dihydroxyphenyl)-N(2)-Methyl-
• Molecular Formula: C₁₂H₁₆N₂O₅
• Molecular Weight: 268.27
• CAS Registry Number: 76500-09-9
• SMILES: [C@@H](N(C1=CC=C(O)C(=C1)O)C)(C(=O)O)CCC(=O)N
• InChI: 1S/C12H16N2O5/c1-14(7-2-4-9(15)10(16)6-7)8(12(18)19)3-5-11(13)17/h2,4,6,8,15-16H,3,5H2,1H3,(H2,13,17)(H,18,19)/t8-/m0/s1
• InChIKey: DOACJPGLGGWIGS-QMMMGPOBSA-N

Properties

• Density: 1.441g/cm³ (Cal.)
• Boiling point: 663.984°C at 760 mmHg (Cal.)
• Flash point: 355.365°C (Cal.)