o-(Methoxymethyl)carbanilic acid 2-(1-pyrrolidinyl)ethyl ester oxalate (1:1)
[CAS# 80171-55-7]

Identification

• Name: o-(Methoxymethyl)carbanilic acid 2-(1-pyrrolidinyl)ethyl ester oxalate (1:1)
• Synonyms: 2-Hydroxy-2-Oxo-Acetate; 2-Pyrrolidin-1-Ium-1-Ylethyl N-[2-(Methoxymethyl)Phenyl]Carbamate; 2-Hydroxy-2-Oxoacetate; N-[2-(Methoxymethyl)Phenyl]Carbamic Acid 2-(1-Pyrrolidin-1-Iumyl)Ethyl Ester; N-[2-(Methoxymethyl)Phenyl]Carbamic Acid 2-Pyrrolidin-1-Ium-1-Ylethyl Ester Bioxalate
• Molecular Formula: C₁₇H₂₄N₂O₇
• Molecular Weight: 368.39
• CAS Registry Number: 80171-55-7
• SMILES: C2=C(NC(OCC[NH+]1CCCC1)=O)C(=CC=C2)COC.O=C([O-])C(=O)O
• InChI: 1S/C15H22N2O3.C2H2O4/c1-19-12-13-6-2-3-7-14(13)16-15(18)20-11-10-17-8-4-5-9-17;3-1(4)2(5)6/h2-3,6-7H,4-5,8-12H2,1H3,(H,16,18);(H,3,4)(H,5,6)
• InChIKey: LOCNHDWAEIDJQV-UHFFFAOYSA-N

Properties

• Boiling point: 361.1°C at 760 mmHg (Cal.)
• Flash point: 172.2°C (Cal.)