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3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE

3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE structure

CAS No:
838871-76-4
Formula:
C12H11NOS2
Chemical Name:
3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE
Synonyms:
SCHEMBL6023075;CTK5F1373;3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE;DTXSID30700687;3-[3,3-Bis(methylsulfanyl)acryloyl]benzonitrile;3-[3,3-BIS(METHYLSULFANYL)PROP-2-ENOYL]BENZONITRILE;Benzonitrile,3-[3,3-bis(methylthio)-1-oxo-2-propen-1-yl]-

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3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE Basic Attributes

Molecular Weight：

249.35184

Exact Mass：

249.028

DSSTox ID：

DTXSID30700687

HScode：

2930909090

Characteristics

PSA：

91.5

XLogP3：

2.6

Computed Properties

Molecular Weight:249.4
XLogP3:2.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:249.02820632
Monoisotopic Mass:249.02820632
Topological Polar Surface Area:91.5
Heavy Atom Count:16
Complexity:323
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE

Basic Attributes
Characteristics
Computed Properties

3-(3,3-BIS-METHYLSULFANYL-ACRYLOYL)-BENZONITRILE

SDS

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