2-(3-Amino-3-Carboxypropyl)Isoxazolin-5-One
[CAS# 60102-46-7]

Identification

• Name: 2-(3-Amino-3-Carboxypropyl)Isoxazolin-5-One
• Synonyms: 2-Amino-4-(5-Oxoisoxazol-2-Yl)Butanoic Acid; 2-Amino-4-(5-Oxo-2-Isoxazolyl)Butanoic Acid; 2-Amino-4-(5-Ketoisoxazol-2-Yl)Butyric Acid
• Molecular Formula: C₇H₁₀N₂O₄
• Molecular Weight: 186.17
• CAS Registry Number: 60102-46-7
• SMILES: C(C(C(=O)O)N)CN1OC(C=C1)=O
• InChI: 1S/C7H10N2O4/c8-5(7(11)12)1-3-9-4-2-6(10)13-9/h2,4-5H,1,3,8H2,(H,11,12)
• InChIKey: NBBBAGCVWNMFPG-UHFFFAOYSA-N

Properties

• Density: 1.433g/cm³ (Cal.)
• Boiling point: 369.467°C at 760 mmHg (Cal.)
• Flash point: 177.248°C (Cal.)