Abanoquil monomethanesulfonate
[CAS# 118931-00-3]

Identification

• Name: Abanoquil monomethanesulfonate
• Synonyms: 2-(6,7-Dimethoxy-3,4-Dihydro-1H-Isoquinolin-2-Yl)-6,7-Dimethoxy-Quinolin-4-Amine; Methanesulfonic Acid; 2-(6,7-Dimethoxy-3,4-Dihydro-1H-Isoquinolin-2-Yl)-6,7-Dimethoxy-4-Quinolinamine; Methanesulfonic Acid; [2-(6,7-Dimethoxy-3,4-Dihydro-1H-Isoquinolin-2-Yl)-6,7-Dimethoxy-4-Quinolyl]Amine; Methanesulfonic Acid
• Molecular Formula: C₂₃H₂₉N₃O₇S
• Molecular Weight: 491.56
• CAS Registry Number: 118931-00-3
• SMILES: C[S](=O)(=O)O.C3=C(N1CC2=C(CC1)C=C(OC)C(=C2)OC)N=C4C(=C3N)C=C(OC)C(=C4)OC
• InChI: 1S/C22H25N3O4.CH4O3S/c1-26-18-7-13-5-6-25(12-14(13)8-19(18)27-2)22-10-16(23)15-9-20(28-3)21(29-4)11-17(15)24-22;1-5(2,3)4/h7-11H,5-6,12H2,1-4H3,(H2,23,24);1H3,(H,2,3,4)
• InChIKey: FMDPOTBKJNHQLC-UHFFFAOYSA-N

Properties

• Boiling point: 630.3°C at 760 mmHg (Cal.)
• Flash point: 335°C (Cal.)