4-{[Bis(Carboxymethyl)Amino]Methyl}-3-Hydroxy-2-Naphthoic Acid
[CAS# 21542-48-3]

Identification

• Name: 4-{[Bis(Carboxymethyl)Amino]Methyl}-3-Hydroxy-2-Naphthoic Acid
• Synonyms: (3-Carboxy-2-hydroxynaphtyl)-methylene iminodiacetic acid; 4-[(Bis-carboxymethyl-amino)-methyl]-3-hydroxy-naphthalene-2-carboxylic acid; 4-{[bis(carboxymethyl)amino]methyl }-3-hydroxy-2-naphthoic acid
• Molecular Formula: C₁₆H₁₅NO₇
• Molecular Weight: 333.29
• CAS Registry Number: 21542-48-3
• SMILES: OC(=O)CN(CC(O)=O)Cc1c2ccccc2cc(C(O)=O)c1O
• InChI: 1S/C16H15NO7/c18-13(19)7-17(8-14(20)21)6-12-10-4-2-1-3-9(10)5-11(15(12)22)16(23)24/h1-5,22H,6-8H2,(H,18,19)(H,20,21)(H,23,24)
• InChIKey: MTKGUPAGIGMUNP-UHFFFAOYSA-N

Properties

• Density: 1.562g/cm³ (Cal.)
• Boiling point: 615.386°C at 760 mmHg (Cal.)
• Flash point: 325.974°C (Cal.)
• Refractive index: 1.708 (Cal.)