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Home > Encyclopedia > 6-Chloro-2-iodo-benzaldehyde

6-Chloro-2-iodo-benzaldehyde

6-Chloro-2-iodo-benzaldehyde structure

6-Chloro-2-iodo-benzaldehyde 

structure
  • CAS No:

    51738-07-9

  • Formula:

    C7H4ClIO

  • Chemical Name:

    6-Chloro-2-iodo-benzaldehyde

  • Synonyms:

    2-chloro-6-iodobenzaldehyde;6-Chloro-2-iodo-benzaldehyde;6-Chloro-2-iodobenzaldehyde;PubChem22998;2-Chloro-6-iodo-benzaldehyde;SCHEMBL953519;Benzaldehyde, 2-chloro-6-iodo-;DTXSID90730682;KS-00000QY6;ZINC75629664

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

6-Chloro-2-iodo-benzaldehyde Basic Attributes

266.46353

265.9

DTXSID90730682

Characteristics

17.1

2.7

1.971±0.06 g/cm3(Predicted)

289.6±25.0°C at 760 mmHg

6-Chloro-2-iodo-benzaldehyde Use and Manufacturing

b) 2-Chloro-6-iodo-benzaldehyde; To a solution of 3.11 ml (36.2 mmol) oxalyl chloride in 40 ml dichloromethane at -78° C. was added dropwise over 20 min a solution of 5.14 ml (72.4 mmol) dimethylsulfoxide in 15 ml dichloromethane. The mixture was stirred for a further 15 min at -78° C. and then a solution of 8.10 g (3.02 mmol) (2-chloro-6-iodo-phenyl)-methanol in 40 ml dichloromethane was added dropwise over 30 min and stirring continued at -78° C. for a further 45 min. 20.9 ml (151 mmol) triethylamine were then added dropwise and the reaction mixture allowed to warm to room temperature. Water was then added and the phases were then separated. The organic phase was dried over Na2SO4, filtered and concentrated in vacuo to afford 8.35 g (100percent) of the title compound as a yellow crystalline solid which was used in the next step without further purification. MS (EI): 268.0 (44percent) 266.0 (100percent) (M+*).

Computed Properties

Molecular Weight:266.46
XLogP3:2.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:265.89954
Monoisotopic Mass:265.89954
Topological Polar Surface Area:17.1
Heavy Atom Count:10
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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