methyl 2-cyano-3-methylbutanoate
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methyl 2-cyano-3-methylbutanoate
structure -
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CAS No:
52752-25-7
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Formula:
C7H11NO2
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Chemical Name:
methyl 2-cyano-3-methylbutanoate
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Synonyms:
Methyl 2-cyano-3-methylbutanoate;Methyl 2-cyano-3-methylbutyrate;52752-25-7;ACMC-20lvpq;Butanoic acid, 2-cyano-3-methyl-, methyl ester;SCHEMBL7527654;methyl alpha-isopropylcyanoacetate;Methyl 2-cyano-3-methylbutanoate #;AKOS013907531;2-Cyano-3-methylbutanoic acid methyl ester;Butanoic acid, 2-cyano-3-methyl-, methyl ester, (S)-;92265-42-4
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CAS No:
Computed Properties
Molecular Weight:141.17
XLogP3:1.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:141.078978594
Monoisotopic Mass:141.078978594
Topological Polar Surface Area:50.1
Heavy Atom Count:10
Complexity:166
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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