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Home > Encyclopedia > 4-Fluoro-2-iodo-1-nitrobenzene

4-Fluoro-2-iodo-1-nitrobenzene

4-Fluoro-2-iodo-1-nitrobenzene structure

4-Fluoro-2-iodo-1-nitrobenzene 

structure
  • CAS No:

    41860-64-4

  • Formula:

    C6H3FINO2

  • Chemical Name:

    4-Fluoro-2-iodo-1-nitrobenzene

  • Synonyms:

    Benzene,4-fluoro-2-iodo-1-nitro-;4-Fluoro-2-iodo-1-nitrobenzene

  • Categories:

    Chemical Reagents  >  Organic Reagents

4-Fluoro-2-iodo-1-nitrobenzene Basic Attributes

266.9963932

267.00

DTXSID40598370

Characteristics

45.8

2.5

2.1±0.1 g/cm3

148°C/20mmHg(lit.)

122.6±23.2 °C

1.635

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Fluoro-2-iodo-1-nitrobenzene Use and Manufacturing

To a solution of 5-fluoro-2-nitroaniline (70.0 g, 448 mmol) in HCl (350 mL, 37percent in water) at 0° C. was added sodium nitrite (32.2 g, 469 mmol, in 100 mL water) dropwise. The mixture was stirred for 1 h at which time, potassium iodide (82.0 g, 490 mmol, in 100 mL HSilak reaction tube equipped with a magnetic stirrer was added11.4 mg of copper iodide, 5.9 mg of 1, 10-phenanthroline, 37 mg of 2-nitro-5-fluorobenzoic acid, 36 mg of sodium iodide and 4 mL of dimethylsulfoxide.The reaction was heated at 160 ° C for 24 hours in the presence of oxygen.After the reaction was completed, distilled water was added to quench the reaction, Extraction with ethyl acetate 3 times, each time 10mL, The combined organic phases are concentrated, 31.5 mg of 2-nitro-5-fluoroiodobenzene was obtained, The yield is 59percent.

Computed Properties

Molecular Weight:267.00
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Exact Mass:266.91925
Monoisotopic Mass:266.91925
Topological Polar Surface Area:45.8
Heavy Atom Count:11
Complexity:161
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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