1,3-Dimethyl-1H-Imidazol-3-Ium-2-Carboxylate
[CAS# 536755-29-0]

Identification

• Name: 1,3-Dimethyl-1H-Imidazol-3-Ium-2-Carboxylate
• Molecular Formula: C₆H₈N₂O₂
• Molecular Weight: 140.14
• CAS Registry Number: 536755-29-0
• SMILES: CN1C=C[N+](=C1C(=O)[O-])C
• InChI: 1S/C6H8N2O2/c1-7-3-4-8(2)5(7)6(9)10/h3-4H,1-2H3
• InChIKey: HESZXGSSISDCNI-UHFFFAOYSA-N

Properties

• Refractive index: (Cal.)

References

• (1): Schmidt Andreas. Imidazol-2-and-4-ylidene by decarboxylation. Studies on the cross-conjugated mesomeric betaine-alkaloid norzooanemonine and its pseudo-cross-conjugated isomer, Organic & Biomolecular Chemistry, 2008