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21561-99-9

21561-99-9 structural image
Product Name: 1-METHYL-1-NITROSO-3-PHENYLUREA
Formula: C8H9N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 179.18 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 179.069476538 g/mol
Monoisotopic Mass 179.069476538 g/mol
Topological Polar Surface Area 61.8 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 190
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