2-cyano-3-methylpentanoic acid
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2-cyano-3-methylpentanoic acid
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CAS No:
857479-95-9
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Formula:
C7H11NO2
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Chemical Name:
2-cyano-3-methylpentanoic acid
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Synonyms:
2-cyano-3-methylpentanoic acid;NSC80746;CCG-40383;NSC-80746;AKOS006384336;857479-95-9
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CAS No:
Computed Properties
Molecular Weight:141.17
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:141.078978594
Monoisotopic Mass:141.078978594
Topological Polar Surface Area:61.1
Heavy Atom Count:10
Complexity:168
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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