ChemicalBook--->CAS DataBase List--->148416-38-0

148416-38-0

148416-38-0 Structure

148416-38-0 Structure
IdentificationMore
[Name]

2,3,4-Trifluoro-6-nitroaniline
[CAS]

148416-38-0
[Synonyms]

2,3,4-TRIFLUORO-6-NITROANILINE
2-NITRO-4,5,6-TRIFLUOROANILINE
6-NITRO-2,3,4-TRIFLUOROANILINE
BUTTPARK 24\01-62
6-Nitro-2,3,4-trifluoroaniline 97%
6-Nitro-2,3,4-trifluoroaniline97%
2,3,4-TRIFLUORO-6-NITROANILINE 99%
[Molecular Formula]

C6H3F3N2O2
[MDL Number]

MFCD00174089
[Molecular Weight]

192.1
[MOL File]

148416-38-0.mol
Chemical PropertiesBack Directory
[Melting point ]

59-61 °C(lit.)
[Boiling point ]

287.6±35.0 °C(Predicted)
[density ]

1.653±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

soluble in Methanol
[form ]

Powder
[pka]

-2.75±0.25(Predicted)
[color ]

White
[CAS DataBase Reference]

148416-38-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,T,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

TOXIC
[HS Code ]

29214200
Hazard InformationBack Directory
[Chemical Properties]

White to yellow solid
[Synthesis]

N-(2,3,4-trifluorophenyl)acetaMide

365-29-7

2,3,4-Trifluoro-6-nitroaniline

148416-38-0

The general procedure for the synthesis of 2,3,4-trifluoro-6-nitroaniline using N-(2,3,4-trifluorophenyl)acetamide as starting material was as follows: concentrated nitric acid (1.25 mL) was added slowly and dropwise to a solution of sulfuric acid (14 mL) of 2,3,4-trifluoroacetanilide (4.34 g) obtained from step 1 under ice bath conditions. The reaction mixture was maintained under stirring for 4 hours. Subsequently, crushed ice was added to the reaction mixture and the precipitated yellow solid was collected by filtration to afford 2,3,4-trifluoro-6-nitroaniline (1.56 g, 35% yield). The infrared spectrum (IR, cm?1, pure) of the product showed characteristic absorption peaks located at 3483, 3361, 1664, 1600, 1540, 1515. nuclear magnetic resonance hydrogen spectroscopy (1H NMR) data: δ 6.10 (broad single peak, D?O exchangeable, 2H), 7.80 (multiple peaks, 1H). Mass spectra (EI-MS) showed molecular ion peak m/z: 192 (M?), and fragment ion peaks m/z: 175, 119.

[References]

[1] Journal of Medicinal Chemistry, 1995, vol. 38, # 22, p. 4367 - 4379
[2] Patent: WO2004/37765, 2004, A1. Location in patent: Page 8
[3] Journal of Fluorine Chemistry, 2003, vol. 121, # 2, p. 171 - 175
Spectrum DetailBack Directory
[Spectrum Detail]

2,3,4-Trifluoro-6-nitroaniline(148416-38-0)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,3,4-trifluoro-6-nitroaniline(148416-38-0)
[Sigma Aldrich]

148416-38-0(sigmaaldrich)
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