4-(Methylsulfinyl)butanenitrile
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4-(Methylsulfinyl)butanenitrile
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CAS No:
61121-65-1
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Formula:
C5H9NOS
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Chemical Name:
4-(Methylsulfinyl)butanenitrile
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Synonyms:
Butanenitrile,4-(methylsulfinyl)-;4-(Methylsulfinyl)butanenitrile;1-Cyano-3-methylsulfinylpropane;NSC 321800;4-(Methylsulfinyl)butylnitrile;73814-25-2
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CAS No:
Safety Information
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P312, P322, P330, P342+P311, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:131.20
XLogP3:-0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:131.04048508
Monoisotopic Mass:131.04048508
Topological Polar Surface Area:60.1
Heavy Atom Count:8
Complexity:124
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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