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1,1'-Carbonylbis(3-methylimidazolium) triflate

CAS No.
120418-31-7
Chemical Name:
1,1'-Carbonylbis(3-methylimidazolium) triflate
Synonyms
1,1'-Carbonylbis(3-methylimidazolium) triflate;1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) triflate;1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) ditriflate;bis(3-methylimidazol-3-ium-1-yl)methanone,trifluoromethanesulfonate;1,1'-Carbonyldi(3-methyl-1H-imidazol-3-ium) trifluoromethanesulphonate;1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) trifluoromethanesulfonate;1,1'-Carbonylbis[3-Methyl-1H-iMidazoliuM 1,1,1-TrifluoroMethanesulfonate;1,1'-Carbonylbis (3-methyl-1H-imidazol-3-ium) trifluoromethanesulfonic acid;1,1'-Carbonylbis(3-Methyl-1H-Imidazol-3-Ium) Bis(Trifluoromethanesulfonate);1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) bis(trifluoromethanesulphonate)
CBNumber:
CB5501133
Molecular Formula:
C9H12N4O.CF3O3S
Molecular Weight:
490.3568
MDL Number:
MFCD00269944
MOL File:
120418-31-7.mol
MSDS File:
SDS
Last updated:2026-09-12 18:53:35

1,1'-Carbonylbis(3-methylimidazolium) triflate Properties

Melting point 78-80
storage temp. Hygroscopic, -20°C Freezer, Under Inert Atmosphere
solubility Acetonitrile (Slightly), DMSO (Sparingly), Methanol (Slightly)
form solid
color White to off-white
Stability Hygroscopic
InChI InChI=1S/C9H12N4O.2CHF3O3S/c1-10-3-5-12(7-10)9(14)13-6-4-11(2)8-13;2*2-1(3,4)8(5,6)7/h3-8H,1-2H3;2*(H,5,6,7)/q+2;;/p-2
InChIKey BWBZTXSPTHTBBM-UHFFFAOYSA-L
SMILES C(F)(F)(F)S(=O)([O-])=O.C(F)(F)(F)S([O-])(=O)=O.C(=O)(N1C=C[N+](C)=C1)N1C=C[N+](C)=C1

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes  Xi
HS Code  2933299090

1,1'-Carbonylbis(3-methylimidazolium) triflate price More Price(26)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Biosynth FC99808 CBMIT 120418-31-7 50mg $150 2026-06-04 Buy
Biosynth FC99808 CBMIT 120418-31-7 100mg $150 2026-06-04 Buy
Biosynth FC99808 CBMIT 120418-31-7 250mg $160 2026-06-04 Buy
Biosynth FC99808 CBMIT 120418-31-7 500mg $255 2026-06-04 Buy
Biosynth FC99808 CBMIT 120418-31-7 1000mg $380 2026-06-04 Buy
Product number Packaging Price Buy
FC99808 50mg $150 Buy
FC99808 100mg $150 Buy
FC99808 250mg $160 Buy
FC99808 500mg $255 Buy
FC99808 1000mg $380 Buy

1,1'-Carbonylbis(3-methylimidazolium) triflate Chemical Properties,Uses,Production

Chemical Properties

1,1′-Carbonylbis(3-methylimidazolium) Bis(trifluoromethanesulfonate) is a White to Off-White Solid, H δ (CDCl3) 8.86 (s, 2H), 7.44 (m, 2H), 7.16 (m, 2H), 4.00 ;(s, 6H); sol nitromethane, chloroform; insol ether; reacts with water.

Uses

As an efficient reagent for aminoacylations, 1,1'-Carbonylbis(3-MethyliMidazoliuM) Triflate can be used in the synthesis of chiral Pilocarpine analogs via a C-8 ketone intermediate.

Uses

An efficient reagent for aminoacylations. Used in the synthesis of chiral Pilocarpine analogs via a C-8 ketone intermediate.

Preparation

Preparative Methods of 1,1′-Carbonylbis(3-methylimidazolium) Bis(trifluoromethanesulfonate): fresh methyl triflate is added to 1,1-carbonylbisimidazole in nitromethane at 10 °C. Solvent is then removed in vacuo, or the reagent used in situ[1].

storage

1,1′-Carbonylbis(3-methylimidazolium) Bis(trifluoromethanesulfonate) is usually prepared under anhydrous conditions and used immediately. It can be stored in dry nitromethane solution or in solid state in absence of moisture. Preparation using aged methyl triflate should be avoided, owing to possible contamination of the coupling reagent with triflic acid[1].

References

1. Saha, A. K.; Schultz, P.; Rapoport, H. JACS, 1989, 111, 4856.

1,1'-Carbonylbis(3-methylimidazolium) triflate Preparation Products And Raw materials

Raw materials

Preparation Products

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1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) triflate 1,1'-Carbonylbis[3-Methyl-1H-iMidazoliuM 1,1,1-TrifluoroMethanesulfonate 1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) bis(trifluoromethanesulphonate) 1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) ditriflate 1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) trifluoromethanesulfonate 1,1'-Carbonyldi(3-methyl-1H-imidazol-3-ium) trifluoromethanesulphonate 1,1'-Carbonylbis(3-Methyl-1H-Imidazol-3-Ium) Bis(Trifluoromethanesulfonate) bis(3-methylimidazol-3-ium-1-yl)methanone,trifluoromethanesulfonate 1,1'-Carbonylbis (3-methyl-1H-imidazol-3-ium) trifluoromethanesulfonic acid 1,1'-Carbonylbis(3-methylimidazolium) triflate 120418-31-7 C9H12N4OCF3O3S C11H12F6N4O7S2 C9H12N4O2CF3O3S Heterocycles Miscellaneous Reagents