Homozimelidine
[CAS# 112969-65-0]

Identification

• Name: Homozimelidine
• Synonyms: (E)-4-(4-Bromophenyl)-N,N-Dimethyl-4-(3-Pyridyl)But-3-En-1-Amine; Oxalic Acid; [(E)-4-(4-Bromophenyl)-4-(3-Pyridyl)But-3-Enyl]-Dimethyl-Amine; Oxalic Acid; (E)-4-(4-Bromophenyl)-N,N-Dimethyl-4-Pyridin-3-Yl-But-3-En-1-Amine; Ethanedioic Acid
• Molecular Formula: C₁₉H₂₁BrN₂O₄
• Molecular Weight: 421.29
• CAS Registry Number: 112969-65-0
• SMILES: C2=C(\C(C1=CC=CN=C1)=C/CCN(C)C)C=CC(=C2)Br.O=C(O)C(=O)O
• InChI: 1S/C17H19BrN2.C2H2O4/c1-20(2)12-4-6-17(15-5-3-11-19-13-15)14-7-9-16(18)10-8-14;3-1(4)2(5)6/h3,5-11,13H,4,12H2,1-2H3;(H,3,4)(H,5,6)/b17-6+
• InChIKey: GCDKFLJBPHHYNR-ZDEOBDHWSA-N

Properties

• Boiling point: 442.2°C at 760 mmHg (Cal.)
• Flash point: 221.2°C (Cal.)