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20359-57-3

20359-57-3 structural image
Product Name: 1-M-TOLYL-PENTAN-1-ONE
Formula: C12H16O
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COMPUTED DESCRIPTORS

Molecular Weight 176.25 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 176.120115130 g/mol
Monoisotopic Mass 176.120115130 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 163
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