2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile
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2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile
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CAS No:
1111637-81-0
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Formula:
C8H7N3OS
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Chemical Name:
2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile
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Synonyms:
2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile;2-(2-methylsulfanylpyrimidin-4-yl)-3-oxopropanenitrile;SCHEMBL2958337;DTXSID70676938;AKOS015916778;DB-010665;FT-0691512;637M810;ALPHA-FORMYL-2-(METHYLTHIO)-4-PYRIMIDINEACETONITRILE;2-[2-(METHYLSULFANYL)PYRIMIDIN-4-YL]-3-OXOPROPANENITRILE
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CAS No:
2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile Basic Attributes
193.22568
193.03100
DTXSID70676938
2933599090
Computed Properties
Molecular Weight:193.23
XLogP3:0.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:193.03098303
Monoisotopic Mass:193.03098303
Topological Polar Surface Area:91.9
Heavy Atom Count:13
Complexity:225
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(2-(methylthio)pyrimidin-4-yl)-3-oxopropanenitrile
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