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1268520-16-6

1268520-16-6 structural image
Product Name: 1-Methyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-5-carboxylic acid tert-butyl ester
Formula: C11H17N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 223.27 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 223.132076794 g/mol
Monoisotopic Mass 223.132076794 g/mol
Topological Polar Surface Area 47.4 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 287
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