1-{Hydroxy[2-(6-Methoxy-3-Oxo-3H-Xanthen-9-Yl)Phenyl]Methylene}-4-Piperidiniumcarboxylate
[CAS# 442151-56-6]

Identification

• Name: 1-{Hydroxy[2-(6-Methoxy-3-Oxo-3H-Xanthen-9-Yl)Phenyl]Methylene}-4-Piperidiniumcarboxylate
• Synonyms: 1-(O′-Methylfluoresceinyl)piperidine-4-carboxylic acid; 1-(O'-Methylfluoresceinyl)piperidine-4-carboxylic acid; 1-[2-(6-Methoxy-3-oxo-3H-xanthen-9-yl)benzoyl]piperidine-4-carboxylic acid
• Molecular Formula: C₂₇H₂₃NO₆
• Molecular Weight: 457.47
• CAS Registry Number: 442151-56-6
• SMILES: [O-]C(=O)C5CC/[N+](=C(\O)c4ccccc4C=1c3c(OC=2C=1\C=C/C(=O)C=2)cc(OC)cc3)CC5
• InChI: 1S/C27H23NO6/c1-33-18-7-9-22-24(15-18)34-23-14-17(29)6-8-21(23)25(22)19-4-2-3-5-20(19)26(30)28-12-10-16(11-13-28)27(31)32/h2-9,14-16H,10-13H2,1H3,(H,31,32)
• InChIKey: DELBHVBSPUGXDG-UHFFFAOYSA-N

Properties

• Density: 1.41g/cm³ (Cal.)
• Boiling point: 759.7°C at 760 mmHg (Cal.)
• Flash point: 413.2°C (Cal.)
• Refractive index: 1.686 (Cal.)