Desmethylmaprotiline
[CAS# 5721-37-9]

Identification

• Name: Desmethylmaprotiline
• Synonyms: Isopropyl 4-(6-Bromo-1,3-Benzodioxol-5-Yl)-7-(4-Methoxyphenyl)-2-Methyl-5-Oxo-4,6,7,8-Tetrahydro-1H-Quinoline-3-Carboxylate; 4-(6-Bromo-1,3-Benzodioxol-5-Yl)-7-(4-Methoxyphenyl)-2-Methyl-5-Oxo-4,6,7,8-Tetrahydro-1H-Quinoline-3-Carboxylic Acid Isopropyl Ester; 4-(6-Bromo-1,3-Benzodioxol-5-Yl)-5-Keto-7-(4-Methoxyphenyl)-2-Methyl-4,6,7,8-Tetrahydro-1H-Quinoline-3-Carboxylic Acid Isopropyl Ester
• Molecular Formula: C₂₈H₂₈BrNO₆
• Molecular Weight: 554.44
• CAS Registry Number: 5721-37-9
• SMILES: C2=C1OCOC1=CC(=C2C3C5=C(NC(=C3C(OC(C)C)=O)C)CC(C4=CC=C(C=C4)OC)CC5=O)Br
• InChI: 1S/C28H28BrNO6/c1-14(2)36-28(32)25-15(3)30-21-9-17(16-5-7-18(33-4)8-6-16)10-22(31)27(21)26(25)19-11-23-24(12-20(19)29)35-13-34-23/h5-8,11-12,14,17,26,30H,9-10,13H2,1-4H3
• InChIKey: KFHKMMHGGFDJBK-UHFFFAOYSA-N

Properties

• Density: 1.464g/cm³ (Cal.)
• Boiling point: 640.764°C at 760 mmHg (Cal.)
• Flash point: 341.322°C (Cal.)