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541-95-7

541-95-7 structural image
Product Name: hedonal
Formula: C6H13NO2
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COMPUTED DESCRIPTORS

Molecular Weight 131.17 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 131.094628657 g/mol
Monoisotopic Mass 131.094628657 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 93.1
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