346640

4-Fluoro-3-nitrobenzotrifluoride

96%

• Synonym(s): 3-Nitro-α,α,α,4-tetrafluorotoluene, 4,α,α,α-Tetrafluoro-3-nitrotoluene, FNBT
• Linear Formula: FC₆H₃(NO₂)CF₃
• CAS Number: 367-86-2
• Molecular Weight: 209.10
• Beilstein: 1880508
• EC Number: 206-702-5
• MDL number: MFCD00007059
• UNSPSC Code: 12352100
• PubChem Substance ID: 24861423
• NACRES: NA.22

Properties

• Assay: 96%
• form: liquid
• refractive index: n20/D 1.462 (lit.)
• bp: 92 °C/15 mmHg (lit.)
• density: 1.494 g/mL at 25 °C (lit.)
• functional group: fluoro; nitro
• 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

Safety Information

• Pictograms: GHS02,GHS07
• Signal Word: Warning
• Hazard Statements: H226,H315,H319,H335
• Precautionary Statements: P210 - P233 - P240 - P241 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 3
• Flash Point(F): 91.4 °F - closed cup
• Flash Point(C): 33 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves