N-[(1-Nitroso-2-Pyrrolidinyl)Carbonyl]Alanine
[CAS# 95326-12-8]

Identification

• Name: N-[(1-Nitroso-2-Pyrrolidinyl)Carbonyl]Alanine
• Synonyms: (2S)-2-[[[(2S)-1-Nitroso-2-Pyrrolidinyl]-Oxomethyl]Amino]Propanoic Acid; (2S)-2-[[(2S)-1-Nitrosopyrrolidine-2-Carbonyl]Amino]Propionic Acid; (2S)-2-[[(2S)-1-Nitrosopyrrolidin-2-Yl]Carbonylamino]Propanoic Acid
• Molecular Formula: C₈H₁₃N₃O₄
• Molecular Weight: 215.21
• CAS Registry Number: 95326-12-8
• SMILES: [C@H]1(CCCN1N=O)C(N[C@H](C(O)=O)C)=O
• InChI: 1S/C8H13N3O4/c1-5(8(13)14)9-7(12)6-3-2-4-11(6)10-15/h5-6H,2-4H2,1H3,(H,9,12)(H,13,14)/t5-,6-/m0/s1
• InChIKey: VNOIMGCGNAIBIO-WDSKDSINSA-N

Properties

• Density: 1.522g/cm³ (Cal.)
• Boiling point: 568.757°C at 760 mmHg (Cal.)
• Flash point: 297.774°C (Cal.)