4a,8,12b-Trihydroxy-4-methyl-1H-benzo[a]anthracene-2,7,12-trione
[CAS# 56257-16-0]

Identification

• Name: 4a,8,12b-Trihydroxy-4-methyl-1H-benzo[a]anthracene-2,7,12-trione
• Synonyms: 4A,12B-Dihydro-4A,8,12B-Trihydroxy-4-Methylbenz(A)Anthracene-2,7,12(Lh)-Trione; Antibiotic Ss-228 Y; Benz(A)Anthracene-2,7,12(1H)-Trione, 4A,12B-Dihydro-4-Methyl-4A,8,12B-Trihydroxy
• Molecular Formula: C₁₉H₁₄O₆
• Molecular Weight: 338.32
• CAS Registry Number: 56257-16-0
• SMILES: C1=CC=C(C2=C1C(C3=C(C2=O)C=CC4(C3(CC(C=C4C)=O)O)O)=O)O
• InChI: 1S/C19H14O6/c1-9-7-10(20)8-19(25)15-12(5-6-18(9,19)24)16(22)14-11(17(15)23)3-2-4-13(14)21/h2-7,21,24-25H,8H2,1H3
• InChIKey: SFKKPGUZOCFOBH-UHFFFAOYSA-N

Properties

• Density: 1.618g/cm³ (Cal.)
• Boiling point: 685.352°C at 760 mmHg (Cal.)
• Flash point: 382.258°C (Cal.)