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106824-45-7

106824-45-7 structural image
Product Name: 2-HEX-1-YNYL-BENZALDEHYDE
Formula: C13H14O
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COMPUTED DESCRIPTORS

Molecular Weight 186.25 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 186.104465066 g/mol
Monoisotopic Mass 186.104465066 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 230
Isotope Atom Count 0
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