N-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-beta-alanine
[CAS# 96360-24-6]

Identification

• Name: N-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-beta-alanine
• Synonyms: 3-(3,5-Dioxo-2,3,4,5-tetrahydro-[1,2,4]triazin-6-ylamino)-propionic acid; 3-[(3,5-dioxo-2H,4H-1,2,4-triazin-6-yl)amino]propanoic acid; N-(3,5-dihydroxy-1,2,4-triazin-6-yl)-β-alanine
• Molecular Formula: C₆H₈N₄O₄
• Molecular Weight: 200.15
• CAS Registry Number: 96360-24-6
• SMILES: C(CNc1c(=O)[nH]c(=O)[nH]n1)C(=O)O
• InChI: 1S/C6H8N4O4/c11-3(12)1-2-7-4-5(13)8-6(14)10-9-4/h1-2H2,(H,7,9)(H,11,12)(H2,8,10,13,14)
• InChIKey: XNGPOEDDHLRSKP-UHFFFAOYSA-N

Properties

• Density: 1.8±0.1g/cm³ (Cal.)