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83016-51-7

83016-51-7 structural image
Product Name: (+)-3-(4-Isocyano-6-oxabicyclo(3.1.0)hex-3-en-1-yl)-2-propenoic acid
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COMPUTED DESCRIPTORS

Molecular Weight 177.16 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 177.042593085 g/mol
Monoisotopic Mass 177.042593085 g/mol
Topological Polar Surface Area 54.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 374
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes