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77716-16-6

77716-16-6 structural image
Product Name: 4-TERT-BUTOXYCARBONYLAMINO-1-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID BENZOTRIAZOL-1YL ESTER
Formula: C17H19N5O4
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COMPUTED DESCRIPTORS

Molecular Weight 357.4 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 357.14370410 g/mol
Monoisotopic Mass 357.14370410 g/mol
Topological Polar Surface Area 100 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 538
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