2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE
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2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE
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CAS No:
114444-10-9
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Formula:
C14H9ClN2O
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Chemical Name:
2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE
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Synonyms:
2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE;α-(3-Chlorophenyl)-β-oxo-3-pyridinepropanenitrile
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CAS No:
2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE Basic Attributes
256.68706
256.04
DTXSID90655866
Characteristics
53.8
2.7
1.299±0.06 g/cm3(Predicted)
177-178°C
436.8±40.0 °C(Predicted)
218ºC
1.608
7.85E-08mmHg at 25°C
Computed Properties
Molecular Weight:256.68
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:256.0403406
Monoisotopic Mass:256.0403406
Topological Polar Surface Area:53.8
Heavy Atom Count:18
Complexity:349
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE
2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL)-1-ETHANONE
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