3,4-Dihydro-N,N-Diethyl-7-Methyl-1-Phenyl-3-Isoquinolinemethanamine (Z)-2-Butenedioate (1:2)
[CAS# 83658-67-7]

Identification

• Name: 3,4-Dihydro-N,N-Diethyl-7-Methyl-1-Phenyl-3-Isoquinolinemethanamine (Z)-2-Butenedioate (1:2)
• Synonyms: But-2-Enedioic Acid; Diethyl-[(7-Methyl-1-Phenyl-3,4-Dihydroisoquinolin-3-Yl)Methyl]Amine; 3-Isoquinolinemethanamine, 3,4-Dihydro-N,N-Diethyl-7-Methyl-1-Phenyl-, (Z)-2-Butenedioate(1:2)
• Molecular Formula: C₂₉H₃₄N₂O₈
• Molecular Weight: 538.60
• CAS Registry Number: 83658-67-7
• SMILES: O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O.C(N(CC)CC)C1N=C(C2=C(C1)C=CC(=C2)C)C3=CC=CC=C3
• InChI: 1S/C21H26N2.2C4H4O4/c1-4-23(5-2)15-19-14-18-12-11-16(3)13-20(18)21(22-19)17-9-7-6-8-10-17;2*5-3(6)1-2-4(7)8/h6-13,19H,4-5,14-15H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+
• InChIKey: YWZUCYORRONJJL-LVEZLNDCSA-N

Properties

• Boiling point: 422°C at 760 mmHg (Cal.)
• Flash point: 209°C (Cal.)