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Copper(II) trifluoromethanesulphonate

  • Name Copper(II) trifluoromethanesulphonate
  • EINECS252-300-8
  • CAS No. 34946-82-2
  • DensityN/A
  • PSA103.50000
  • LogP2.79290
  • SolubilitySoluble in water.
  • Melting Point≥300 °C
  • FormulaC2CuF6O6S2
  • Boiling Point162 °C at 760 mmHg
  • Molecular Weight361.687
  • Flash PointN/A
  • Transport InformationUN 3261 8/PG 2
  • Appearancesolid
  • Safety26-36/37/39-45-27
  • Risk Codes34
  • Molecular Structure
    Molecular Structure of 34946-82-2 (COPPER(II) TRIFLUOROMETHANESULFONATE)
  • Hazard SymbolsCorrosiveC,IrritantXi
  • SynonymsCorrosiveC,IrritantXi
  • Article Data38

Copper(II) trifluoromethanesulphonate Specification

The Copper(II) trifluoromethanesulphonate, with CAS registry number 34946-82-2, belongs to the following product categories: (1)Biochemistry; (2)Catalysts for Organic Synthesis; (3)Classes of Metal Compounds; (4)Cu (Copper) Compounds; (5)Homogeneous Catalysts; (6)Metal Triflates; (7)Reagents for Oligosaccharide Synthesis; (8)Synthetic Organic Chemistry; (9)Transition Metal Compounds. It has the systematic name of copper(2+) bis(trifluoromethanesulfonate). This chemical is a kind of white to slightly blue or light grey cryst. powder. And this chemical can be prepared by Copper(II) carbonate and Trifluoromethanesulfonic acid.

Physical properties of Copper(II) trifluoromethanesulphonate: (1)ACD/LogP: -0.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.87; (4)ACD/LogD (pH 7.4): -3.87; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 62.75 Å2; (13)Boiling Point: 162 °C at 760 mmHg; (14)Vapour Pressure: 1.14 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Copper(II) trifluoromethanesulphonate may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. After using it, take off immediately all contaminated clothing. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: [Cu+2].FC(F)(F)S([O-])(=O)=O.FC(F)(F)S([O-])(=O)=O
(2)InChI: InChI=1/2CHF3O3S.Cu/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2
(3)InChIKey: SBTSVTLGWRLWOD-NUQVWONBAL
(4)Std. InChI: InChI=1S/2CHF3O3S.Cu/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2
(5)Std. InChIKey: SBTSVTLGWRLWOD-UHFFFAOYSA-L

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