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1334528-90-3

1334528-90-3 structural image
Product Name: (E)-3-(3,4-difluorophenyl)acrylaldehyde
Formula: C9H6F2O
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COMPUTED DESCRIPTORS

Molecular Weight 168.14 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 168.03867113 g/mol
Monoisotopic Mass 168.03867113 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 179
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes