AKOSB013872
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AKOSB013872
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CAS No:
869948-83-4
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Formula:
C11H13NO5
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Chemical Name:
AKOSB013872
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Synonyms:
ART-CHEM-BB B013872;AKOS B013872;2-(4-Methyl-2-nitrophenoxy)butanoic acid;Butanoic acid, 2-(4-methyl-2-nitrophenoxy)-
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CAS No:
Computed Properties
Molecular Weight:239.22
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:239.07937252
Monoisotopic Mass:239.07937252
Topological Polar Surface Area:92.4
Heavy Atom Count:17
Complexity:288
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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