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4-phenylsulfanylbutanenitrile

4-phenylsulfanylbutanenitrile structure

4-phenylsulfanylbutanenitrile 

structure
  • CAS No:

    35756-39-9

  • Formula:

    C10H11NS

  • Chemical Name:

    4-phenylsulfanylbutanenitrile

  • Synonyms:

    4-phenylsulfanylbutanenitrile;35756-39-9;4-phenylthiobutyronitrile;NSC115083;SCHEMBL10494843;DTXSID10297282;4-(PHENYLTHIO)BUTYRONITRILE;ZINC1704965;AKOS000216532;MCULE-6612191080;NSC-115083;DS-015385

4-phenylsulfanylbutanenitrile Basic Attributes

177.27 g/mol

177.06122053 g/mol

115083

DTXSID10297282

Characteristics

49.1 Ų

Computed Properties

Molecular Weight:177.27
XLogP3:2.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:177.06122053
Monoisotopic Mass:177.06122053
Topological Polar Surface Area:49.1
Heavy Atom Count:12
Complexity:153
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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