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52939-00-1

52939-00-1 structural image
Product Name: 5-(4-NITROPHENYL)FURAN-2-CARBOXYLIC ACID METHYL ESTER
Formula: C12H9NO5
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COMPUTED DESCRIPTORS

Molecular Weight 247.20 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 247.04807239 g/mol
Monoisotopic Mass 247.04807239 g/mol
Topological Polar Surface Area 85.3 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 319
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes