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131924-52-2

131924-52-2 structural image
Product Name: 4H-1-Benzopyran-4-one, 2-(1-methyl-1H-1,2,3-triazol-5-yl)-6-nitro-
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COMPUTED DESCRIPTORS

Molecular Weight 272.22 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 272.05455475 g/mol
Monoisotopic Mass 272.05455475 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 461
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