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618101-68-1

618101-68-1 structural image
Product Name: 1-(4-METHOXYPHENYL)-3-(4-NITROPHENYL)-1H-PYRAZOLE-4-CARBALDEHYDE
Formula: C17H13N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 323.30 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 323.09060590 g/mol
Monoisotopic Mass 323.09060590 g/mol
Topological Polar Surface Area 89.9 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 440
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