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56346-72-6

56346-72-6 structural image
Product Name: 1-chloro-4-methylhexan-2-one
Formula: C7H13ClO
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1031

COMPUTED DESCRIPTORS

Molecular Weight 148.63 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 148.0654927 g/mol
Monoisotopic Mass 148.0654927 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 90.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes