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2003765-62-4

2003765-62-4 structural image
Product Name: tert-butyl N-[(4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]carbamate
Formula: C9H16N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 228.25 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 228.12224039 g/mol
Monoisotopic Mass 228.12224039 g/mol
Topological Polar Surface Area 83 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 332
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