o-(Propoxymethyl)carbanilic acid 2-piperidinoethyl ester oxalate (1:1)
[CAS# 80171-71-7]

Identification

• Name: o-(Propoxymethyl)carbanilic acid 2-piperidinoethyl ester oxalate (1:1)
• Synonyms: 2-Hydroxy-2-Oxo-Acetate; 2-Piperidin-1-Ium-1-Ylethyl N-[2-(Propoxymethyl)Phenyl]Carbamate; 2-Hydroxy-2-Oxoacetate; N-[2-(Propoxymethyl)Phenyl]Carbamic Acid 2-(1-Piperidin-1-Iumyl)Ethyl Ester; N-[2-(Propoxymethyl)Phenyl]Carbamic Acid 2-Piperidin-1-Ium-1-Ylethyl Ester Bioxalate
• Molecular Formula: C₂₀H₃₀N₂O₇
• Molecular Weight: 410.47
• CAS Registry Number: 80171-71-7
• SMILES: C2=C(NC(OCC[NH+]1CCCCC1)=O)C(=CC=C2)COCCC.O=C([O-])C(=O)O
• InChI: 1S/C18H28N2O3.C2H2O4/c1-2-13-22-15-16-8-4-5-9-17(16)19-18(21)23-14-12-20-10-6-3-7-11-20;3-1(4)2(5)6/h4-5,8-9H,2-3,6-7,10-15H2,1H3,(H,19,21);(H,3,4)(H,5,6)
• InChIKey: XLYPTZOJCGJIPN-UHFFFAOYSA-N

Properties

• Boiling point: 406.1°C at 760 mmHg (Cal.)
• Flash point: 199.4°C (Cal.)