1,3-Dihydroxy-8-Methoxy-3-Methyl-2,4-Dihydro-1H-Benzo[a]Anthracene-7,12-Dione
[CAS# 135635-83-5]

Identification

• Name: 1,3-Dihydroxy-8-Methoxy-3-Methyl-2,4-Dihydro-1H-Benzo[a]Anthracene-7,12-Dione
• Synonyms: 1,3-Dihydroxy-8-Methoxy-3-Methyl-2,4-Dihydro-1H-Benzo[A]Anthracene-7,12-Quinone; Benz(A)Anthracene-7,12-Dione, 1,2,3,4-Tetrahydro-1,3-Dihydroxy-8-Methoxy-3-Methyl-; Sm 196B
• Molecular Formula: C₂₀H₁₈O₅
• Molecular Weight: 338.36
• CAS Registry Number: 135635-83-5
• SMILES: C1=CC4=C(C2=C1C(=O)C3=C(C2=O)C=CC=C3OC)C(O)CC(O)(C4)C
• InChI: 1S/C20H18O5/c1-20(24)8-10-6-7-12-17(15(10)13(21)9-20)19(23)11-4-3-5-14(25-2)16(11)18(12)22/h3-7,13,21,24H,8-9H2,1-2H3
• InChIKey: ZTVTUCVOMPBGIG-UHFFFAOYSA-N

Properties

• Density: 1.396g/cm³ (Cal.)
• Boiling point: 601.516°C at 760 mmHg (Cal.)
• Flash point: 220.443°C (Cal.)