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3-PHENYLISONICOTINIC ACID

3-PHENYLISONICOTINIC ACID structure

3-PHENYLISONICOTINIC ACID 

structure
  • CAS No:

    104096-15-3

  • Formula:

    C12H9NO2

  • Chemical Name:

    3-PHENYLISONICOTINIC ACID

  • Synonyms:

    3-Phenylisonicotinic acid;3-phenylpyridine-4-carboxylic Acid;4-Pyridinecarboxylicacid, 3-phenyl-;4-Pyridinecarboxylic acid, 3-phenyl-;PubChem22106;ACMC-1BPOZ;SCHEMBL2749796;CTK0H3540;KS-00003TFN;DTXSID30376588

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

3-PHENYLISONICOTINIC ACID Basic Attributes

199.21

199.06300

DTXSID30376588

2933399090

Characteristics

50.2

2.44680

1.241±0.06 g/cm3(Predicted)

431.8±25.0 °C(Predicted)

215ºC

1.613

3.18E-08mmHg at 25°C

Computed Properties

Molecular Weight:199.20
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:199.063328530
Monoisotopic Mass:199.063328530
Topological Polar Surface Area:50.2
Heavy Atom Count:15
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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