N-(1-Methyl-2-(4-n-butylpiperazino)ethyl)aniline dioxalate hemihydrate
[CAS# 77562-88-0]

Identification

• Name: N-(1-Methyl-2-(4-n-butylpiperazino)ethyl)aniline dioxalate hemihydrate
• Synonyms: 1-(2-Butyl-4-Phenyl-Piperazin-1-Yl)Propan-2-Amine; Oxalic Acid; 1-(2-Butyl-4-Phenyl-1-Piperazinyl)Propan-2-Amine; Oxalic Acid; [2-(2-Butyl-4-Phenyl-Piperazin-1-Yl)-1-Methyl-Ethyl]Amine; Oxalic Acid
• Molecular Formula: C₂₁H₃₃N₃O₈
• Molecular Weight: 455.51
• CAS Registry Number: 77562-88-0
• SMILES: O=C(O)C(=O)O.O=C(O)C(=O)O.C(N2C(CN(C1=CC=CC=C1)CC2)CCCC)C(N)C
• InChI: 1S/C17H29N3.2C2H2O4/c1-3-4-8-17-14-20(16-9-6-5-7-10-16)12-11-19(17)13-15(2)18;2*3-1(4)2(5)6/h5-7,9-10,15,17H,3-4,8,11-14,18H2,1-2H3;2*(H,3,4)(H,5,6)
• InChIKey: AWYNHRHCIJELDT-UHFFFAOYSA-N

Properties

• Boiling point: 395.8°C at 760 mmHg (Cal.)
• Flash point: 190.2°C (Cal.)