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898786-91-9

898786-91-9 structural image
Product Name: 3'-ACETOXY-5-CHLOROVALEROPHENONE
Formula: C13H15ClO3
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COMPUTED DESCRIPTORS

Molecular Weight 254.71 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 254.0709720 g/mol
Monoisotopic Mass 254.0709720 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 265
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