2-[[(2S)-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]Propanoyl]Amino]Acetic Acid Hydrate
[CAS# 148750-86-1]

Identification

• Name: 2-[[(2S)-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]Propanoyl]Amino]Acetic Acid Hydrate
• Synonyms: 2-[[(2S)-2-(Tert-Butoxycarbonylamino)Propanoyl]Amino]Acetic Acid Hydrate; 2-[[(2S)-2-[(Tert-Butoxy-Oxomethyl)Amino]-1-Oxopropyl]Amino]Acetic Acid Hydrate; 2-[[(2S)-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]Propanoyl]Amino]Ethanoic Acid Hydrate
• Molecular Formula: C₁₀H₂₀N₂O₆
• Molecular Weight: 264.28
• CAS Registry Number: 148750-86-1
• SMILES: [C@H](C(NCC(=O)O)=O)(NC(=O)OC(C)(C)C)C.O
• InChI: 1S/C10H18N2O5.H2O/c1-6(8(15)11-5-7(13)14)12-9(16)17-10(2,3)4;/h6H,5H2,1-4H3,(H,11,15)(H,12,16)(H,13,14);1H2/t6-;/m0./s1
• InChIKey: KWPRIABABOYKQJ-RGMNGODLSA-N

Properties

• Boiling point: 484.4°C at 760 mmHg (Cal.)
• Flash point: 246.8°C (Cal.)