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9-Oxoageraphorone

9-Oxoageraphorone structure

9-Oxoageraphorone 

structure
  • CAS No:

    105181-06-4

  • Formula:

    C15H22O2

  • Chemical Name:

    9-Oxoageraphorone

  • Synonyms:

    9-Oxoageraphorone;(1S,4R,4aS,8aR)-1,3,4,4a,5,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)-2,6-naphthalenedione

  • Categories:

    Natural Products  >  Sesquiterpene

9-Oxoageraphorone Basic Attributes

234.33398

234.161987

Characteristics

34.14000

2.48

1.0±0.1 g/cm3

356.1±41.0 °C at 760 mmHg

133.6±24.6 °C

1.485

Computed Properties

Molecular Weight:234.33
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:234.161979940
Monoisotopic Mass:234.161979940
Topological Polar Surface Area:34.1
Heavy Atom Count:17
Complexity:378
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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