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1,1'-CARBONYLBIS(3-METHYLIMIDAZOLIUM) TRIFLATE

Product Name
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) Bis(Trifluoromethanesulfonate);1,1'-Carbonylbis(3-methyl-1H-imidazol-3-ium) bis(trifluoromethanesulphonate)
CBNumber
CB5501133
Molecular Formula
C9H12N4O.CF3O3S
Formula Weight
490.3568
MOL File
120418-31-7.mol
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1,1'-CARBONYLBIS(3-METHYLIMIDAZOLIUM) TRIFLATE Property

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
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Safety

Hazard Codes 
Xi
HS Code 
2933299090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P321Specific treatment (see … on this label).

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P362Take off contaminated clothing and wash before reuse.

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N-Bromosuccinimide Price

TRC
Product number
C177000
Product name
1,1''-Carbonylbis(3-methylimidazolium)Triflate
Packaging
5g
Price
$790
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
CHM0017050
Product name
1,1'-CARBONYLBIS(3-METHYLIMIDAZOLIUM) TRIFLATE
Purity
95.00%
Packaging
1G
Price
$795.8
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC99808
Product name
1,1'-Carbonylbis(3-Methyl-1H-Imidazol-3-Ium) Bis(Trifluoromethanesulfonate)
Packaging
50mg
Price
$50
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC99808
Product name
1,1'-Carbonylbis(3-Methyl-1H-Imidazol-3-Ium) Bis(Trifluoromethanesulfonate)
Packaging
100mg
Price
$80
Updated
2021/12/16
AK Scientific
Product number
0394BB
Product name
1,1'-Carbonylbis(3-methylimidazolium)triflate
Packaging
50mg
Price
$117
Updated
2021/12/16
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1,1'-CARBONYLBIS(3-METHYLIMIDAZOLIUM) TRIFLATE Chemical Properties,Usage,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

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

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.

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-METHYLIMIDAZOLIUM) TRIFLATE Suppliers

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120418-31-7, 1,1'-CARBONYLBIS(3-METHYLIMIDAZOLIUM) TRIFLATERelated Search:


  • 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-METHYLIMIDAZOLIUM) TRIFLATE
  • 120418-31-7
  • C9H12N4OCF3O3S
  • C11H12F6N4O7S2
  • C9H12N4O2CF3O3S
  • Heterocycles
  • Miscellaneous Reagents