rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile
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![rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d2d796155f0b4947899e7cca67d82bf1.png "rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile")
rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile
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CAS No:
25858-24-6
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Formula:
C20H22N2O2S
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Chemical Name:
rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile
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Synonyms:
4-Piperidinecarbonitrile,3-methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-,(3R,4S)-rel-;Isonipecotonitrile,3-methyl-4-phenyl-1-(p-tolylsulfonyl)-,trans-;rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile
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CAS No:
rel-(3R,4S)-3-Methyl-1-[(4-methylphenyl)sulfonyl]-4-phenyl-4-piperidinecarbonitrile Basic Attributes
354.5 g/mol
354.47
607-821-9
DTXSID90180507
Computed Properties
Molecular Weight:354.5
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:354.14019912
Monoisotopic Mass:354.14019912
Topological Polar Surface Area:69.6
Heavy Atom Count:25
Complexity:603
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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