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Home > Encyclopedia > α-Acetyl-3,4-dichlorobenzeneacetonitrile

α-Acetyl-3,4-dichlorobenzeneacetonitrile

α-Acetyl-3,4-dichlorobenzeneacetonitrile structure

α-Acetyl-3,4-dichlorobenzeneacetonitrile 

structure
  • CAS No:

    6097-31-0

  • Formula:

    C10H7Cl2NO

  • Chemical Name:

    α-Acetyl-3,4-dichlorobenzeneacetonitrile

  • Synonyms:

    Benzeneacetonitrile,α-acetyl-3,4-dichloro-;Acetoacetonitrile,2-(3,4-dichlorophenyl)-;α-Acetyl-3,4-dichlorobenzeneacetonitrile;2-(3,4-Dichloro-phenyl)-acetoacetonitrile;2-(3,4-Dichlorophenyl)-3-oxobutanenitrile

α-Acetyl-3,4-dichlorobenzeneacetonitrile Basic Attributes

228.077

228.07

DTXSID40545223

Characteristics

40.9

3.18958

1.338g/cm3

161-163 °C

303.4ºC at 760 mmHg

137.3ºC

1.556

Computed Properties

Molecular Weight:228.07
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:226.9904692
Monoisotopic Mass:226.9904692
Topological Polar Surface Area:40.9
Heavy Atom Count:14
Complexity:271
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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