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18641-71-9

18641-71-9 structural image
Product Name: 2,4-DIMETHYL-3-HEPTANONE
Formula: C9H18O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1456

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Flame
Flammables
GHS02
GHS Hazard Statements H226:Flammable liquids
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.

COMPUTED DESCRIPTORS

Molecular Weight 142.24 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 142.135765193 g/mol
Monoisotopic Mass 142.135765193 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 105
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