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14681-31-3

14681-31-3 structural image
Product Name: Bicyclo[2.2.1]heptan-2-one, 3-(hydroxymethylene)-1,7,7-trimethyl-, (1R,4S)-
Formula: C11H16O2
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COMPUTED DESCRIPTORS

Molecular Weight 180.24 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 180.115029749 g/mol
Monoisotopic Mass 180.115029749 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 301
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes