3-oxobutyl thiocyanate
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3-oxobutyl thiocyanate
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CAS No:
57308-66-4
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Formula:
C5H7NOS
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Chemical Name:
3-oxobutyl thiocyanate
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Synonyms:
4-Thiocyanato-2-butanone;4-thiocyanatobutan-2-one;3-Oxobutyl thiocyanate #;Thiocyanic acid,3-oxobutyl ester;57308-66-4
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CAS No:
Computed Properties
Molecular Weight:129.18
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:129.02483502
Monoisotopic Mass:129.02483502
Topological Polar Surface Area:66.2
Heavy Atom Count:8
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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