Butantrone
[CAS# 75464-11-8]

Identification

• Name: Butantrone
• Synonyms: 1,8-Dihydroxy-10-(1-Oxobutyl)-10H-Anthracen-9-One; 10-Butyryl-1,8-Dihydroxy-10H-Anthracen-9-One; 10-Butyryl Dithranol
• Molecular Formula: C₁₈H₁₆O₄
• Molecular Weight: 296.32
• CAS Registry Number: 75464-11-8
• SMILES: C1=CC=C(C3=C1C(C2=C(C(=CC=C2)O)C3=O)C(CCC)=O)O
• InChI: 1S/C18H16O4/c1-2-5-12(19)15-10-6-3-8-13(20)16(10)18(22)17-11(15)7-4-9-14(17)21/h3-4,6-9,15,20-21H,2,5H2,1H3
• InChIKey: AHZXFRRDQXXPJD-UHFFFAOYSA-N

Properties

• Density: 1.325g/cm³ (Cal.)
• Boiling point: 490.124°C at 760 mmHg (Cal.)
• Flash point: 264.319°C (Cal.)