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817-71-0

817-71-0 structural image
Product Name: 2-Pentanone, 1-bromo-
Formula: C5H9BrO
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COMPUTED DESCRIPTORS

Molecular Weight 165.03 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 163.98368 g/mol
Monoisotopic Mass 163.98368 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 61.1
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