5-(Acetyloxy)-12-Methylbenz(a)Anthracene-7-Methanol
[CAS# 64365-35-1]

Identification

• Name: 5-(Acetyloxy)-12-Methylbenz(a)Anthracene-7-Methanol
• Synonyms: [7-(Hydroxymethyl)-12-Methyl-Benzo[B]Phenanthren-5-Yl] Acetate; Acetic Acid [7-(Hydroxymethyl)-12-Methyl-5-Benzo[B]Phenanthrenyl] Ester; Acetic Acid (12-Methyl-7-Methylol-Benzo[B]Phenanthren-5-Yl) Ester
• Molecular Formula: C₂₂H₁₈O₃
• Molecular Weight: 330.38
• CAS Registry Number: 64365-35-1
• SMILES: C3=C(C1=CC=CC=C1C4=C(C2=CC=CC=C2C(=C34)CO)C)OC(=O)C
• InChI: 1S/C22H18O3/c1-13-15-7-3-4-8-16(15)20(12-23)19-11-21(25-14(2)24)17-9-5-6-10-18(17)22(13)19/h3-11,23H,12H2,1-2H3
• InChIKey: BRNAGVGDWKOSGO-UHFFFAOYSA-N

Properties

• Density: 1.273g/cm³ (Cal.)
• Boiling point: 580.698°C at 760 mmHg (Cal.)
• Flash point: 244.004°C (Cal.)