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Dimethylionone

Dimethylionone structure

Dimethylionone 

structure
  • CAS No:

    72117-72-7

  • Formula:

    C15H24O

  • Chemical Name:

    Dimethylionone

  • Synonyms:

    1-Penten-3-one,2-methyl-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-;2-Methyl-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-1-penten-3-one;Dimethylionone

Dimethylionone Basic Attributes

220.35000

220.35

Characteristics

17.07000

4.29430

0.924g/cm3

100-102 °C @ Press: 0.3 Torr

131.7ºC

1.505

Dimethylionone Use and Manufacturing

1-Penten-3-one, 2-methyl-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:220.35
XLogP3:3.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:220.182715385
Monoisotopic Mass:220.182715385
Topological Polar Surface Area:17.1
Heavy Atom Count:16
Complexity:331
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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