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294852-57-6

294852-57-6 structural image
Product Name: 5-TERT-BUTYL-2H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
Formula: C10H16N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 196.25 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 196.121177757 g/mol
Monoisotopic Mass 196.121177757 g/mol
Topological Polar Surface Area 55 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 211
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