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24646-25-1

24646-25-1 structural image
Product Name: methyl 2-(4-nitrophenyl)butanoate
Formula: C11H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 223.22 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 223.08445790 g/mol
Monoisotopic Mass 223.08445790 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 253
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes