2,2',2'',2'''-[(2-Hydroxy-5-Methyl-1,3-Phenylene)Bis(Methylenenitrilo)]Tetraacetic Acid
[CAS# 55036-44-7]

Identification

• Name: 2,2',2'',2'''-[(2-Hydroxy-5-Methyl-1,3-Phenylene)Bis(Methylenenitrilo)]Tetraacetic Acid
• Synonyms: ({3-[(Bis-carboxymethyl-amino)-methyl ]-2-hydroxy-5-methyl-benzyl}-carboxymethyl-amino)-acetic acid; ({3-[(Bis-carboxymethyl-amino)-methyl]-2-hydroxy-5-methyl-benzyl}-carboxymethyl-amino)-acetic acid; 2-Hydroxy-5-methyl-m-phenylenedimethylenedinitrilotetraacetic acid
• Molecular Formula: C₁₇H₂₂N₂O₉
• Molecular Weight: 398.36
• CAS Registry Number: 55036-44-7
• SMILES: O=C(O)CN(CC(=O)O)Cc1cc(cc(c1O)CN(CC(=O)O)CC(=O)O)C
• InChI: 1S/C17H22N2O9/c1-10-2-11(4-18(6-13(20)21)7-14(22)23)17(28)12(3-10)5-19(8-15(24)25)9-16(26)27/h2-3,28H,4-9H2,1H3,(H,20,21)(H,22,23)(H,24,25)(H,26,27)
• InChIKey: OHQPBRGLFSUSFH-UHFFFAOYSA-N

Properties

• Density: 1.521g/cm³ (Cal.)
• Boiling point: 694.338°C at 760 mmHg (Cal.)
• Flash point: 373.723°C (Cal.)