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3-Formyl-4-nitrobenzonitrile

3-Formyl-4-nitrobenzonitrile structure

3-Formyl-4-nitrobenzonitrile 

structure
  • CAS No:

    90178-82-8

  • Formula:

    C8H4N2O3

  • Chemical Name:

    3-Formyl-4-nitrobenzonitrile

  • Synonyms:

    Benzonitrile,3-formyl-4-nitro-;3-Formyl-4-nitrobenzonitrile;5-Cyano-2-nitrobenzaldehyde;3-Formyl-4-nitrobenzonitril

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

3-Formyl-4-nitrobenzonitrile Basic Attributes

176.131

176.13

DTXSID40531101

2926909090

Characteristics

86.7

1.5

1.40±0.1 g/cm3(Predicted)

329.1±32.0°C at 760 mmHg

3-Formyl-4-nitrobenzonitrile Use and Manufacturing

3-Formyl-4-nitrobenzonitrile is the tri-substitiuted derivative of benzene. 3-Formyl-4-nitrobenzonitrile is an intermediate used in the synthetic preparation of various pharmaceuticals exhibiting larg e spectrum of activity.

Computed Properties

Molecular Weight:176.13
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:176.02219199
Monoisotopic Mass:176.02219199
Topological Polar Surface Area:86.7
Heavy Atom Count:13
Complexity:262
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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