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1164506-63-1

1164506-63-1 structural image
Product Name: 4-(4-CHLOROPHENOXY)-1-(DIMETHYLAMINO)-1-PENTEN-3-ONE
Formula: C13H16ClNO2
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COMPUTED DESCRIPTORS

Molecular Weight 253.72 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 253.0869564 g/mol
Monoisotopic Mass 253.0869564 g/mol
Topological Polar Surface Area 29.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 271
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes