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Home > Encyclopedia > 3-(4-Cyanophenyl)benzoic acid

3-(4-Cyanophenyl)benzoic acid

3-(4-Cyanophenyl)benzoic acid structure

3-(4-Cyanophenyl)benzoic acid 

structure
  • CAS No:

    149506-93-4

  • Formula:

    C14H9NO2

  • Chemical Name:

    3-(4-Cyanophenyl)benzoic acid

  • Synonyms:

    3-(4-Cyanophenyl)benzoic acid;3-(4-Cyanophenyl)benzoic acid, 4-(3-Carboxyphenyl)benzonitrile, 3-Carboxy-4'-cyanobiphenyl;4'-Cyano-3-biphenylcarboxylic acid

3-(4-Cyanophenyl)benzoic acid Basic Attributes

223.231

223.06300

DTXSID40374090

2926909090

Characteristics

61.1

2.92348

1.30±0.1 g/cm3(Predicted)

463.0±38.0 °C(Predicted)

Safety Information

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

Computed Properties

Molecular Weight:223.23
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:223.063328530
Monoisotopic Mass:223.063328530
Topological Polar Surface Area:61.1
Heavy Atom Count:17
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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