2-Hydroxy-3-(3-Hydroxy-3-Methylbutyl)-1,4-Naphthalenedione
[CAS# 15298-01-8]

Identification

• Name: 2-Hydroxy-3-(3-Hydroxy-3-Methylbutyl)-1,4-Naphthalenedione
• Synonyms: 4-Hydroxy-3-(3-Hydroxy-3-Methyl-Butyl)Naphthalene-1,2-Dione; 4-Hydroxy-3-(3-Hydroxy-3-Methyl-Butyl)-1,2-Naphthoquinone; Nciopen2_006881
• Molecular Formula: C₁₅H₁₆O₄
• Molecular Weight: 260.29
• CAS Registry Number: 15298-01-8
• SMILES: C2=C1C(=C(CCC(O)(C)C)C(=O)C(=O)C1=CC=C2)O
• InChI: 1S/C15H16O4/c1-15(2,19)8-7-11-12(16)9-5-3-4-6-10(9)13(17)14(11)18/h3-6,16,19H,7-8H2,1-2H3
• InChIKey: XKHIPCDZGJWMJE-UHFFFAOYSA-N

Properties

• Density: 1.3g/cm³ (Cal.)
• Boiling point: 452.224°C at 760 mmHg (Cal.)
• Flash point: 241.423°C (Cal.)