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amino[4-(methylthio)phenyl]acetonitrile

amino[4-(methylthio)phenyl]acetonitrile structure

CAS No:
93554-85-9
Formula:
C9H10N2S
Chemical Name:
amino[4-(methylthio)phenyl]acetonitrile
Synonyms:
AMINO[4-(METHYLTHIO)PHENYL]ACETONITRILE;AGN-PC-0NEJFN;2-amino-2-(4-methylsulfanylphenyl)acetonitrile;SCHEMBL15775527;CTK5H2652;DTXSID30452078;AKOS000123807

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amino[4-(methylthio)phenyl]acetonitrile Basic Attributes

Molecular Weight：

178.253

Exact Mass：

178.056

DSSTox ID：

DTXSID30452078

Characteristics

PSA：

75.1

XLogP3：

1.3

Computed Properties

Molecular Weight:178.26
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:178.05646950
Monoisotopic Mass:178.05646950
Topological Polar Surface Area:75.1
Heavy Atom Count:12
Complexity:176
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of amino[4-(methylthio)phenyl]acetonitrile

Basic Attributes
Characteristics
Computed Properties

amino[4-(methylthio)phenyl]acetonitrile

SDS

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