(2S)-2-Amino-3-[[(E)-3-Carbamoylprop-2-Enoyl]Amino]Propanoic Acid
[CAS# 91235-43-7]

Identification

• Name: (2S)-2-Amino-3-[[(E)-3-Carbamoylprop-2-Enoyl]Amino]Propanoic Acid
• Synonyms: (2S)-2-Amino-3-[[(E)-4-Amino-4-Oxo-But-2-Enoyl]Amino]Propanoic Acid; (2S)-2-Amino-3-[[(E)-4-Amino-1,4-Dioxobut-2-Enyl]Amino]Propanoic Acid; (2S)-2-Amino-3-[[(E)-4-Amino-4-Keto-But-2-Enoyl]Amino]Propionic Acid
• Molecular Formula: C₇H₁₁N₃O₄
• Molecular Weight: 201.18
• CAS Registry Number: 91235-43-7
• SMILES: [C@H](C(=O)O)(N)CNC(\C=C\C(=O)N)=O
• InChI: 1S/C7H11N3O4/c8-4(7(13)14)3-10-6(12)2-1-5(9)11/h1-2,4H,3,8H2,(H2,9,11)(H,10,12)(H,13,14)/b2-1+/t4-/m0/s1
• InChIKey: TXNRYTCUNXUNFH-QPHDTYRISA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 611.968°C at 760 mmHg (Cal.)
• Flash point: 323.907°C (Cal.)