2-(4-chlorobenzoyl)-1H-isoquinoline-1-carbonitrile
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2-(4-chlorobenzoyl)-1H-isoquinoline-1-carbonitrile
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CAS No:
58021-74-2
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Formula:
C17H11ClN2O
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Chemical Name:
2-(4-chlorobenzoyl)-1H-isoquinoline-1-carbonitrile
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Synonyms:
58021-74-2;2-(4-chlorobenzoyl)-1,2-dihydroisoquinoline-1-carbonitrile;NSC116708;DTXSID30297587;AKOS024372597;MCULE-4225892192;NSC-116708;ST51010370;2-[(4-chlorophenyl)carbonyl]-1,2-dihydroisoquinolinecarbonitrile
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CAS No:
2-(4-chlorobenzoyl)-1H-isoquinoline-1-carbonitrile Basic Attributes
294.7 g/mol
294.0559907 g/mol
116708
DTXSID30297587
Computed Properties
Molecular Weight:294.7
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:294.0559907
Monoisotopic Mass:294.0559907
Topological Polar Surface Area:44.1
Heavy Atom Count:21
Complexity:472
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(4-chlorobenzoyl)-1H-isoquinoline-1-carbonitrile
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