[(4-Chlorophenyl)-Isoquinolin-1-Yl-Methyl] Benzoate
[CAS# 54923-37-4]

Identification

• Name: [(4-Chlorophenyl)-Isoquinolin-1-Yl-Methyl] Benzoate
• Synonyms: [(4-Chlorophenyl)-(1-Isoquinolyl)Methyl] Benzoate; Benzoic Acid [(4-Chlorophenyl)-(1-Isoquinolyl)Methyl] Ester; [(4-Chlorophenyl)-Isoquinolin-1-Yl-Methyl] Benzoate
• Molecular Formula: C₂₃H₁₆ClNO₂
• Molecular Weight: 373.84
• CAS Registry Number: 54923-37-4
• SMILES: C1=CC=CC2=C1C(=NC=C2)C(OC(=O)C3=CC=CC=C3)C4=CC=C(Cl)C=C4
• InChI: 1S/C23H16ClNO2/c24-19-12-10-17(11-13-19)22(27-23(26)18-7-2-1-3-8-18)21-20-9-5-4-6-16(20)14-15-25-21/h1-15,22H
• InChIKey: LECKNMNONXHEAV-UHFFFAOYSA-N

Properties

• Density: 1.284g/cm³ (Cal.)
• Boiling point: 539.514°C at 760 mmHg (Cal.)
• Flash point: 280.088°C (Cal.)