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3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]propanenitrile

3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]propanenitrile structure

CAS No:
327167-27-1
Formula:
C13H15NO2S
Chemical Name:
3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]propanenitrile
Synonyms:
SMR000141113;MLS000533669;CHEMBL1420670;HMS2293C22;ZINC2196936;STK834037;AKOS005623498;MCULE-2773085050;3-[(5-acetyl-2-methoxybenzyl)thio]propanenitrile;SR-01000234369;SR-01000234369-1;3-[(5-acetyl-2-methoxybenzyl)sulfanyl]propanenitrile;327167-27-1

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3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]propanenitrile Basic Attributes

Molecular Weight：

249.33 g/mol

Exact Mass：

249.08234989 g/mol

Characteristics

PSA：

75.4 Å²

Computed Properties

Molecular Weight:249.33
XLogP3:1.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:249.08234989
Monoisotopic Mass:249.08234989
Topological Polar Surface Area:75.4
Heavy Atom Count:17
Complexity:297
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]propanenitrile

Basic Attributes
Characteristics
Computed Properties

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