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Home > Encyclopedia > cis-3,4-Dihydroxy-β-ionone

cis-3,4-Dihydroxy-β-ionone

cis-3,4-Dihydroxy-β-ionone structure

cis-3,4-Dihydroxy-β-ionone 

structure
  • CAS No:

    875666-39-0

  • Formula:

    C13H20O3

  • Chemical Name:

    cis-3,4-Dihydroxy-β-ionone

  • Synonyms:

    cis-3,4-Dihydroxy-β-ionone;(3E)-4-[(3R,4S)-3,4-Dihydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl]-3-buten-2-one;cis-3,4-Dihydroxy-beta-ionone

  • Categories:

    Natural Products  >  Sesquiterpene

cis-3,4-Dihydroxy-β-ionone Basic Attributes

224.2961

224.14124450

Computed Properties

Molecular Weight:224.30
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:224.14124450
Monoisotopic Mass:224.14124450
Topological Polar Surface Area:57.5
Heavy Atom Count:16
Complexity:350
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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