2-Aminonaphthalene-1,4-Dione
[CAS# 2348-81-4]

Identification

• Name: 2-Aminonaphthalene-1,4-Dione
• Synonyms: 2-Amino-1,4-Naphthoquinone; 1,4-Naphthoquinone, 2-Amino- (8Ci); Nsc 7936
• Molecular Formula: C₁₀H₇NO₂
• Molecular Weight: 173.17
• CAS Registry Number: 2348-81-4
• SMILES: C1=CC=CC2=C1C(=O)C(=CC2=O)N
• InChI: 1S/C10H7NO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H,11H2
• InChIKey: CYCRZLRIJWDWCM-UHFFFAOYSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 329.178°C at 760 mmHg (Cal.)
• Flash point: 152.882°C (Cal.)

References

• (1): Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370