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1235406-44-6

1235406-44-6 structural image
Product Name: tert-butyl 4-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-1-carboxylate
Formula: C14H15ClN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 294.73 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 294.0771200 g/mol
Monoisotopic Mass 294.0771200 g/mol
Topological Polar Surface Area 64.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 359
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