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949984-49-0

949984-49-0 structural image
Product Name: 2-CHLORO-N-(8-NITRO-3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)ACETAMIDE
Formula: C11H11ClN2O5
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COMPUTED DESCRIPTORS

Molecular Weight 286.67 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 286.0356491 g/mol
Monoisotopic Mass 286.0356491 g/mol
Topological Polar Surface Area 93.4 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 349
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