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590395-50-9

590395-50-9 structural image
Product Name: 1H-Pyrrole-3-carboxaldehyde,1-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-(9CI)
Formula: C14H14N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 274.27 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 274.09535693 g/mol
Monoisotopic Mass 274.09535693 g/mol
Topological Polar Surface Area 77 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 371
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