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CS-W001157 4
Total: USD 88.00

1,3-Bis(2,4,6-trimethylphenyl)imidazolium bicarbonate

  • CAS No. 1372124-93-0

  • Cat. No. CS-0106228
  • Molecule weight366.45
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1,3-Bis(2,4,6-trimethylphenyl)imidazolium bicarbonate|CS-0106228

Structure of 1372124-93-0

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General Information

  • CAS No. 1372124-93-0
  • Cat. No. CS-0106228
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₂H₂₆N₂O₃
  • Molecular Weight 366.45
  • Synonym(s) ium bicarbonate
  • SMILES OC([O-])=O.CC1=C([N+]2=CN(C3=C(C)C=C(C)C=C3C)C=C2)C(C)=CC(C)=C1

Description

This imidazolium salt features two sterically shielded 2,4,6-trimethylphenyl groups that enhance stability and solubility in organic media. The bicarbonate counterion enables mild basicity and facilitates use in catalytic transformations under ambient conditions. Designed for robust performance in synthetic applications requiring non-nucleophilic anions and hindered cationic centers.

Application

1,3-Bis(2,4,6-trimethylphenyl)imidazolium bicarbonate serves as a stable, bench-accessible precursor for N-heterocyclic carbene (NHC) generation under mild conditions. Its sterically shielded aryl substituents enhance stability and solubility, while the bicarbonate counterion facilitates clean deprotonation. The compound enables reliable access to catalytically active NHCs in cross-coupling, acyl transfer, and C–H functionalization reactions, offering predictable reactivity and ease of handling in routine synthetic workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   69.17
  • LogP   3.49222
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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