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617-72-1

617-72-1 structural image
Product Name: 2-nitroheptane
Formula: C7H15NO2
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COMPUTED DESCRIPTORS

Molecular Weight 145.20 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 145.110278721 g/mol
Monoisotopic Mass 145.110278721 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 98.3
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes