3-[(4-Chlorophenyl)sulfanyl]-11-methyl-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
[CAS# 97416-80-3]

Identification

• Name: 3-[(4-Chlorophenyl)sulfanyl]-11-methyl-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-7-one
• Synonyms: 3(4)-((4-Chlorophenyl)thio)-11-methyl-7-oxo-7H-benzimidazo(2,1-a)benz(de)isoquinoline; 3(Or 4)-((4-chlorophenyl)thio)-11-methyl-7H-benzimidazo(2,1-a)benz(de)isoquinolin-7-one
• Molecular Formula: C₂₅H₁₅ClN₂OS
• Molecular Weight: 426.92
• CAS Registry Number: 97416-80-3
• EINECS: 306-828-1
• SMILES: Clc6ccc(Sc5c3cccc4C(=O)n1c(nc2cc(ccc12)C)c(c34)cc5)cc6
• InChI: 1S/C25H15ClN2OS/c1-14-5-11-21-20(13-14)27-24-18-10-12-22(30-16-8-6-15(26)7-9-16)17-3-2-4-19(23(17)18)25(29)28(21)24/h2-13H,1H3
• InChIKey: UQJPNWRXYFYENA-UHFFFAOYSA-N

Properties

• Density: 1.426g/cm³ (Cal.)
• Boiling point: 746.978°C at 760 mmHg (Cal.)
• Flash point: 405.558°C (Cal.)