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2-Chloro-4-Trifluoromethylbenzaldehyde

2-Chloro-4-Trifluoromethylbenzaldehyde structure

2-Chloro-4-Trifluoromethylbenzaldehyde 

structure
  • CAS No:

    82096-91-1

  • Formula:

    C8H4ClF3O

  • Chemical Name:

    2-Chloro-4-Trifluoromethylbenzaldehyde

  • Synonyms:

    2-Chloro-4-Trifluoromethylbenzaldehyde;2-Chloro-4-(trifluoromethyl)

2-Chloro-4-Trifluoromethylbenzaldehyde Basic Attributes

208.5649696

207.99000

DTXSID80517429

Characteristics

17.1

2.9

2-Chloro-4-Trifluoromethylbenzaldehyde Use and Manufacturing

2-Chloro-4-(trifluoromethyl)benzonitrile (500 mg, 2.43 mmol) was diluted with toluene (3 mL), placed under nitrogen and cooled to -78°C. DIBAL-H (4865 μL, 4.86 mmol) was added dropwise and the reaction was stirred for 1 hour. The reaction was warmed to 0Dissolve 2-chloro-4-trifluoromethylbenzonitrile (405 mg, 1.97 mmol) in anhydrous toluene (7 mL) and cool in a dry ice/ethanol bath. Add diisobutylaluminum EPO

Computed Properties

Molecular Weight:208.56
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:207.9902769
Monoisotopic Mass:207.9902769
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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