2-Hydroxy-5-Amino-2,4,6-Cycloheptatriene-1-One
[CAS# 7021-46-7]

Identification

• Name: 2-Hydroxy-5-Amino-2,4,6-Cycloheptatriene-1-One
• Synonyms: 5-Amino-2-Hydroxy-Cyclohepta-2,4,6-Trien-1-One; 5-Amino-2-Hydroxy-1-Cyclohepta-2,4,6-Trienone; Nsc102877
• Molecular Formula: C₇H₇NO₂
• Molecular Weight: 137.14
• CAS Registry Number: 7021-46-7
• SMILES: O=C1C(=CC=C(N)C=C1)O
• InChI: 1S/C7H7NO2/c8-5-1-3-6(9)7(10)4-2-5/h1-4H,8H2,(H,9,10)
• InChIKey: SJJUTRFFONLOHZ-UHFFFAOYSA-N

Properties

• Density: 1.356g/cm³ (Cal.)
• Boiling point: 262.345°C at 760 mmHg (Cal.)
• Flash point: 112.463°C (Cal.)