365823

2-Fluoro-5-nitrobenzotrifluoride

98%

• Synonym(s): 5-Nitro-α,α,α,2-tetrafluorotoluene
• Linear Formula: FC₆H₃(NO₂)CF₃
• CAS Number: 400-74-8
• Molecular Weight: 209.10
• EC Number: 206-925-8
• MDL number: MFCD00024576
• UNSPSC Code: 12352100
• PubChem Substance ID: 24862583
• NACRES: NA.22

Properties

• assay: 98%
• form: liquid
• refractive index: n20/D 1.465 (lit.)
• bp: 105-110 °C/25 mmHg (lit.)
• density: 1.522 g/mL at 25 °C (lit.)
• SMILES string: [O-][N+](=O)c1ccc(F)c(c1)C(F)(F)F
• InChI: 1S/C7H3F4NO2/c8-6-2-1-4(12(13)14)3-5(6)7(9,10)11/h1-3H
• InChI key: DNTHMWUMRGOJRY-UHFFFAOYSA-N

Description

General description

2-Fluoro-5-nitrobenzotrifluoride is formed during the fluorodenitration of 2-(4-chlorobenzene sulfonyl)-5-nitrotrifluoride using tetramethyl ammonium fluoride.

Application

2-Fluoro-5-nitrobenzotrifluoride may be used in the synthesis of [3-(4-nitro-2-trifluoromethylphenyl)aminophenyl]dihydroxyborane.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 197.6 °F - closed cup
• flash_point_c: 92 °C - closed cup
• ppe: Eyeshields, Gloves, type ABEK (EN14387) respirator filter