3-Methyl-β-oxobenzenepropanenitrile
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3-Methyl-β-oxobenzenepropanenitrile
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CAS No:
53882-81-8
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Formula:
C10H9NO
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Chemical Name:
3-Methyl-β-oxobenzenepropanenitrile
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Synonyms:
Benzenepropanenitrile,3-methyl-β-oxo-;3-Methyl-β-oxobenzenepropanenitrile;m-Toluoylacetonitrile;(3-Methylbenzoyl)acetonitrile;3-Oxo-3-m-tolylpropionitrile;3-Oxo-3-(3-methylphenyl)propanenitrile;3-Oxo-3-m-tolylpropanenitrile;α-Cyano-3-methylacetophenone;3-(3-Methylphenyl)-3-oxopropanenitrile
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CAS No:
Computed Properties
Molecular Weight:159.18
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:159.068413911
Monoisotopic Mass:159.068413911
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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