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13031-33-9

13031-33-9 structural image
Product Name: 1-NITROETHANE-1,1-D2
Formula: C2H3D2NO2
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COMPUTED DESCRIPTORS

Molecular Weight 77.08 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 77.044581894 g/mol
Monoisotopic Mass 77.044581894 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 37.4
Isotope Atom Count 2
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