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890591-56-7

890591-56-7 structural image
Product Name: 3-(4-ETHOXYPHENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
Formula: C12H12N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 232.23 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 232.08479225 g/mol
Monoisotopic Mass 232.08479225 g/mol
Topological Polar Surface Area 75.2 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 265
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