Xanoxate sodium
[CAS# 41147-04-0]

Identification

• Name: Xanoxate sodium
• Synonyms: Sodium 7-Isopropoxy-9-Oxo-Xanthene-2-Carboxylate; Sodium 7-Isopropoxy-9-Oxo-2-Xanthenecarboxylate; Sodium 7-Isopropoxy-9-Keto-Xanthene-2-Carboxylate
• Molecular Formula: C₁₇H₁₃NaO₅
• Molecular Weight: 320.28
• CAS Registry Number: 41147-04-0
• SMILES: C2=C1C(=O)C3=C(OC1=CC=C2C([O-])=O)C=CC(=C3)OC(C)C.[Na+]
• InChI: 1S/C17H14O5.Na/c1-9(2)21-11-4-6-15-13(8-11)16(18)12-7-10(17(19)20)3-5-14(12)22-15;/h3-9H,1-2H3,(H,19,20);/q;+1/p-1
• InChIKey: BOKNZRWXKMUXII-UHFFFAOYSA-M

Properties

• Boiling point: 514.2°C at 760 mmHg (Cal.)
• Flash point: 192.9°C (Cal.)