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3-(5-methylpyridin-2-yl)-3-oxopropanenitrile

3-(5-methylpyridin-2-yl)-3-oxopropanenitrile structure

CAS No:
868395-55-5
Formula:
C9H8N2O
Chemical Name:
3-(5-methylpyridin-2-yl)-3-oxopropanenitrile
Synonyms:
5-Methyl-?-oxo-2-Pyridinepropanenitrile; 3-(5-methylpyridin-2-yl)-3-oxopropionitrile; 2-Pyridinepropanenitrile,5-methyl-b-oxo;

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3-(5-methylpyridin-2-yl)-3-oxopropanenitrile Basic Attributes

Molecular Weight：

160.17300

Exact Mass：

160.063662883

DSSTox ID：

DTXSID70700762

Characteristics

PSA：

53.75000

XLogP3：

1.48638

Density：

1.141g/cm3

Boiling Point：

335.884ºC at 760 mmHg

Flash Point：

156.937ºC

Refractive Index：

1.536

Computed Properties

Molecular Weight:160.17
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:160.063662883
Monoisotopic Mass:160.063662883
Topological Polar Surface Area:53.8
Heavy Atom Count:12
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(5-methylpyridin-2-yl)-3-oxopropanenitrile

Basic Attributes
Characteristics
Computed Properties

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