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346640 Sigma-Aldrich

4-Fluoro-3-nitrobenzotrifluoride

96%

Synonym: 3-Nitro-α,α,α,4-tetrafluorotoluene, 4,α,α,α-Tetrafluoro-3-nitrotoluene, FNBT

  • CAS Number 367-86-2

  • Linear Formula FC6H3(NO2)CF3

  • Molecular Weight 209.10

  •  Beilstein/REAXYS Number 1880508

  •  EC Number 206-702-5

  •  MDL number MFCD00007059

  •  PubChem Substance ID 24861423

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, Chemical Synthesis, Fluorinated Building Blocks, Nitro Compounds, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   96%
refractive index   n20/D 1.462 (lit.)
bp   92 °C/15 mmHg (lit.)
density   1.494 g/mL at 25 °C (lit.)
SMILES string   [O-][N+](=O)c1cc(ccc1F)C(F)(F)F
InChI   1S/C7H3F4NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H
InChI key   HLDFCCHSOZWKAA-UHFFFAOYSA-N

Description

Application

4-Fluoro-3-nitrobenzotrifluoride was used in the pre-column derivatization technique for HPLC with UV/VIS spectrophotometric detection of polyamines. It may be used as derivatization reagent for the HPLC determination of polyamines (spermidine, spermine and the diamine precursor putrescine). It was also used in the synthesis of:
• 2-nitro-4-trifluoromethylphenylhydrazine, derivatization reagent for 1,2-diol compounds and oxo-steroids
• [3-(2-nitro-4-trifluoromethylphenyl)aminophenyl]dihydroxyborane, derivatization reagent for 1,2-diol compounds and oxo-steroids
• 1-(3-chlorophenyl)-5-trifluoromethyl-3-hydrobenzimidazol-2-one

Packaging

100 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
Signal word 
Warning
Hazard statements 
Precautionary statements 
Target organs 
Respiratory system
RIDADR 
UN 1993C 3 / PGIII
WGK Germany 
WGK 3
Flash Point(F) 
91.4 °F - closed cup
Flash Point(C) 
33 °C - closed cup

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Peer-Reviewed Papers
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References

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