a,a,a -Trifluorotoluene anhydrous, (100mL)

SKU:
547948-100ML
  • $53.10

    • Description

    α,α,α-Trifluorotoluene

    anhydrous, ≥99%

    Synonym: Benzotrifluoride

    • CAS Number 98-08-8

       

    • Linear Formula C6H5CF3

       

    • Molecular Weight 146.11

       

    •  Beilstein/REAXYS Number 1906908

       

    •  EC Number 202-635-0

       

    •  MDL number MFCD00000372

       

    •  PubChem Substance ID 57651484

       

    •  NACRES NA.21

    Properties

    Related Categories Anhydrous Solvents, Solvent Bottles, Solvent Packaging Options, Solvent by Application, Solvents,
    Sure/Seal Bottles
    Less...
    Quality Level 100
    grade anhydrous
    vapor density 5.04 (vs air)
    vapor pressure 38.83 mmHg
    assay ≥99%
    expl. lim. 0.34-6.3 % (lit.)
    impurities ≤0.001% water
    water
    refractive index n20/D 1.414 (lit.)
    bp 102 °C (lit.)
    mp −29 °C (lit.)
    density 1.19 g/mL at 20 °C (lit.)
    SMILES string FC(F)(F)c1ccccc1
    InChI 1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H
    InChI key GETTZEONDQJALK-UHFFFAOYSA-N

    General description

    α,α,α-Trifluorotoluene (TFT) is a potential substitute solvent for reactions carried out in dichloromethane and related solvents. It is also applicable in fluorous synthesis as an organic/fluorous hybrid solvent.[1] TFT undergoes photocycloaddition with cyclopentene to form cyano-substituted tetracyclo[6.3.0.02,11.03,7]undec-9-enes.[2] The nuclear magnetic resonance spectral data of TFT has been reported.[3] The bimolecular rate constants of the aqueous phase reactions between sulfate and phosphate radicals with TFT have been determined by conventional flash-photolysis.[4]

    Application

    α,α,α-Trifluorotoluene may be used as an internal standard for 19F NMR spectroscopic determination of copper-catalyzed trifluoromethylation of alkenes.[5]

    Packaging

    1, 2 L in Sure/Seal™

    100 mL in Sure/Seal™

    Safety Information

    Symbol 
    GHS02, GHS09
    Signal word 
    Danger
    Hazard statements 
    H225-H411
    Precautionary statements 
    P210-P273
    Personal Protective Equipment 
    Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
    RIDADR 
    UN 2338 3 / PGII
    WGK Germany 
    1
    RTECS 
    XT9450000
    Flash Point(F) 
    53.6 °F
    Flash Point(C) 
    12 °C