3-Chloro-1-(6,7-Dimethoxyisoquinolin-1-Yl)-1-(3,4-Dimethoxyphenyl)-2-Propanone
[CAS# 66170-03-4]

Identification

• Name: 3-Chloro-1-(6,7-Dimethoxyisoquinolin-1-Yl)-1-(3,4-Dimethoxyphenyl)-2-Propanone
• Synonyms: 3-Chloro-1-(6,7-Dimethoxy-1-Isoquinolyl)-1-(3,4-Dimethoxyphenyl)Propan-2-One; 3-Chloro-1-(6,7-Dimethoxy-1-Isoquinolyl)-1-(3,4-Dimethoxyphenyl)Acetone; 3-Chloro-1-(6,7-Dimethoxy-1-Isoquinolinyl)-1-(3,4-Dimethoxyphenyl)-2-Propanone
• Molecular Formula: C₂₂H₂₂ClNO₅
• Molecular Weight: 415.87
• CAS Registry Number: 66170-03-4
• SMILES: C1=C(C(=CC=C1C(C(CCl)=O)C2=C3C(=CC=N2)C=C(C(=C3)OC)OC)OC)OC
• InChI: 1S/C22H22ClNO5/c1-26-17-6-5-14(10-18(17)27-2)21(16(25)12-23)22-15-11-20(29-4)19(28-3)9-13(15)7-8-24-22/h5-11,21H,12H2,1-4H3
• InChIKey: YHGYHRUDUWFLIS-UHFFFAOYSA-N

Properties

• Density: 1.243g/cm³ (Cal.)
• Boiling point: 550.339°C at 760 mmHg (Cal.)
• Flash point: 286.635°C (Cal.)