N-({3'-Hydroxy-7'-[(Methylamino)Methyl]-3-Oxo-3H-Spiro[2-Benzofuran-1,9'-Xanthen]-2'-Yl}Methyl)-N-Methylglycine
[CAS# 25639-40-1]

Identification

• Name: N-({3'-Hydroxy-7'-[(Methylamino)Methyl]-3-Oxo-3H-Spiro[2-Benzofuran-1,9'-Xanthen]-2'-Yl}Methyl)-N-Methylglycine
• Synonyms: Glycine, N-[[3'-hydroxy-7'-[(methylamino)methyl]-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-2'-yl]methyl]-N-methyl-; METHYL CALCEIN
• Molecular Formula: C₂₆H₂₄N₂O₆
• Molecular Weight: 460.48
• CAS Registry Number: 25639-40-1
• SMILES: CNCc1ccc2c(c1)C3(c4ccccc4C(=O)O3)c5cc(c(cc5O2)O)CN(C)CC(=O)O
• InChI: 1S/C26H24N2O6/c1-27-12-15-7-8-22-19(9-15)26(18-6-4-3-5-17(18)25(32)34-26)20-10-16(13-28(2)14-24(30)31)21(29)11-23(20)33-22/h3-11,27,29H,12-14H2,1-2H3,(H,30,31)
• InChIKey: DSZOZTTXNBNHDJ-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 672.3±55.0°C at 760 mmHg (Cal.)
• Flash point: 360.4±31.5°C (Cal.)
• Refractive index: 1.714 (Cal.)