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393516-79-5

393516-79-5 structural image
Product Name: 2-NITROMETHYL IMIDAZOLE
Formula: C4H5N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 127.10 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 127.038176411 g/mol
Monoisotopic Mass 127.038176411 g/mol
Topological Polar Surface Area 74.5 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 111
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