1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-carboxy-1H-imidazolium Inner Salt - CAS 917604-39-8

Catalog: BB055163
Product Name: 1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-carboxy-1H-imidazolium Inner Salt
CAS: 917604-39-8
Synonyms: 1,3-bis(2,6-diisopropylphenyl)imidazolium-2-carboxylate; 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-2-carboxylate; 1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-carboxy-1H-imidazolium Inner Salt; IPr.CO2
1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-carboxy-1H-imidazolium Inner Salt
IUPAC Name:1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-2-carboxylate
Description:1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-carboxy-1H-imidazolium Inner Salt is synthesized from 1,3-Bis(2,6-diisopropylphenyl)imidazolium Chloride(B426650). 1,3-Bis(2,6-diisopropylphenyl)imidazolium Chloride is used as a reagent in the synthesis of NHC Copper(I) complexes bearing dipyridylamine ligands which exhibit interesting luminescent properties and are potential candidates for organic light-emitting diode applications. 1,3-Bis(2,6-diisopropylphenyl)imidazolium Chloride is also used as a reagent in the synthesis of 5,6-Dimethyl-9-oxo-9H-xanthene-4-acetic Acid Methyl Ester (D476595)
Molecular Weight:432.6
Molecular Formula:C28H36N2O2
Canonical SMILES:CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2C(=O)[O-])C3=C(C=CC=C3C(C)C)C(C)C
InChI:InChI=1S/C28H36N2O2/c1-17(2)21-11-9-12-22(18(3)4)25(21)29-15-16-30(27(29)28(31)32)26-23(19(5)6)13-10-14-24(26)20(7)8/h9-20H,1-8H3
InChI Key:YJFHWSQOLOIECF-UHFFFAOYSA-N
Melting Point:>168°C (dec.)
Solubility:Chloroform (Slightly), Dichloromethane (Slightly), DMSO (Slightly, Heated), Meth
Appearance:Off-White to Pale Beige Solid
Storage:-20°C, Hygroscopic
References:Marion, R., et al. Inorg. Chem., 53, 9181 (2014); Buchanan, C.M., et al. Clin. Sci., 122, 449 (2012); Fruh, M., et al. Clin. Lung. Cancer., 14, 34 (2013).

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