5-Fluoro-7-Hydroxymethyl 12-Methylbenzanthracene Acetate
[CAS# 67639-46-7]

Identification

• Name: 5-Fluoro-7-Hydroxymethyl 12-Methylbenzanthracene Acetate
• Synonyms: (5-Fluoro-12-Methyl-Benzo[B]Phenanthren-7-Yl)Methyl Acetate; Acetic Acid (5-Fluoro-12-Methyl-7-Benzo[B]Phenanthrenyl)Methyl Ester; Acetic Acid (5-Fluoro-12-Methyl-Benzo[B]Phenanthren-7-Yl)Methyl Ester
• Molecular Formula: C₂₂H₁₇FO₂
• Molecular Weight: 332.37
• CAS Registry Number: 67639-46-7
• SMILES: C3=C(C1=CC=CC=C1C4=C(C2=CC=CC=C2C(=C34)COC(C)=O)C)F
• InChI: 1S/C22H17FO2/c1-13-15-7-3-4-8-16(15)20(12-25-14(2)24)19-11-21(23)17-9-5-6-10-18(17)22(13)19/h3-11H,12H2,1-2H3
• InChIKey: BWBNQGMPRXNAEL-UHFFFAOYSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 515.104°C at 760 mmHg (Cal.)
• Flash point: 255.651°C (Cal.)