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34131-98-1

34131-98-1 structural image
Product Name: DECATONE
Formula: C13H22O
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CHEMICAL AND PHYSICAL PROPERTIES

Boiling Point 273.00 to 274.00 °C. @ 760.00 mm Hg
Solubility 32 mg/L @ 20 °C (exp)

COMPUTED DESCRIPTORS

Molecular Weight 194.31 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 194.167065321 g/mol
Monoisotopic Mass 194.167065321 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 219
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes