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4-(4-Pyridinyl)benzeneacetonitrile

4-(4-Pyridinyl)benzeneacetonitrile structure

CAS No:
112170-33-9
Formula:
C13H10N2
Chemical Name:
4-(4-Pyridinyl)benzeneacetonitrile
Synonyms:
Benzeneacetonitrile,4-(4-pyridinyl)-;4-(4-Pyridinyl)benzeneacetonitrile;2-(4-(Pyridine-4-yl)phenyl)acetonitrile;2-[4-(Pyridin-4-yl)phenyl]acetonitrile

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4-(4-Pyridinyl)benzeneacetonitrile Basic Attributes

Molecular Weight：

194.23

Exact Mass：

194.23

DSSTox ID：

DTXSID70554444

Characteristics

Density：

1.115±0.06 g/cm3

Melting Point：

116-117.5 °C

Boiling Point：

200 °C @ Press: 3.5 Torr

PKA：

5.35±0.10

Computed Properties

Molecular Weight:194.23
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:194.084398327
Monoisotopic Mass:194.084398327
Topological Polar Surface Area:36.7
Heavy Atom Count:15
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(4-Pyridinyl)benzeneacetonitrile

Basic Attributes
Characteristics
Computed Properties

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