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175277-04-0

175277-04-0 structural image
Product Name: ETHYL 1-BENZYL-3-(TERT-BUTYL)-1H-PYRAZOLE-5-CARBOXYLATE
Formula: C17H22N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 286.37 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 286.168127949 g/mol
Monoisotopic Mass 286.168127949 g/mol
Topological Polar Surface Area 44.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 345
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