CAS 75701-31-4

Xanthylium, 9-(2,5-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt

Description:

Xanthylium, 9-(2,5-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, identified by CAS number 75701-31-4, is a synthetic organic compound belonging to the xanthene dye family. This substance features a xanthylium core structure, which is characterized by a central xanthene ring system that is typically associated with vibrant colors and fluorescence. The presence of two diethylamino groups enhances its electron-donating properties, contributing to its potential as a dye or fluorescent marker. The 2,5-dicarboxyphenyl substituent introduces carboxylic acid functionalities, which can influence solubility and reactivity, making the compound more versatile in various chemical environments. As an inner salt, it possesses both cationic and anionic characteristics, which can affect its stability and interaction with other molecules. This compound may find applications in fields such as analytical chemistry, biochemistry, and materials science, particularly in the development of fluorescent probes or dyes for imaging and labeling purposes.

Formula: C₂₉H₃₀N₂O₅

InChI: InChI=1S/C29H30N2O5/c1-5-30(6-2)19-10-13-22-25(16-19)36-26-17-20(31(7-3)8-4)11-14-23(26)27(22)24-15-18(28(32)33)9-12-21(24)29(34)35/h9-17H,5-8H2,1-4H3,(H-,32,33,34,35)

InChI key: InChIKey=FAOJCBVUFJXHKQ-UHFFFAOYSA-N

SMILES: C([O-])(=O)C1=C(C=2C3=C([O+]=C4C2C=CC(N(CC)CC)=C4)C=C(N(CC)CC)C=C3)C=C(C(O)=O)C=C1

Synonyms:

• Xanthylium, 9-(2,5-dicarboxyphenyl)-3,6-bis(diethylamino)-, hydroxide, inner salt
• Xanthylium, 9-(2,5-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt