1,3-Diethyl-2-Methyl-1H-Imidazo[4,5-b]Quinoxalinium Toluene-p-Sulphonate
[CAS# 41450-78-6]

Identification

• Name: 1,3-Diethyl-2-Methyl-1H-Imidazo[4,5-b]Quinoxalinium Toluene-p-Sulphonate
• Synonyms: 1H-Imidazo(4,5-B)Quinoxalinium, 1,3-Diethyl-2-Methyl-, Salt With 4-Methylbenzenesulfonic Acid (1:1); 1,3-Diethyl-2-Methyl-1H-Imidazo(4,5-B)Quinoxalinium Toluene-P-Sulphonate
• Molecular Formula: C₂₁H₂₅N₄O₃S
• Molecular Weight: 413.51
• CAS Registry Number: 41450-78-6
• EINECS: 255-370-8
• SMILES: C1=C([S]([O-])(=O)=O)C=CC(=C1)C.C3=CC=CC4=NC2=C(N(C(N2CC)C)CC)N=C34
• InChI: 1S/C14H18N4.C7H8O3S/c1-4-17-10(3)18(5-2)14-13(17)15-11-8-6-7-9-12(11)16-14;1-6-2-4-7(5-3-6)11(8,9)10/h6-10H,4-5H2,1-3H3;2-5H,1H3,(H,8,9,10)/p-1
• InChIKey: JFURRASTIUWPPG-UHFFFAOYSA-M

Properties

• Boiling point: 390.3°C at 760 mmHg (Cal.)
• Flash point: 189.9°C (Cal.)