2-Hydroxy-4,4,6-trimethylcyclohexa-2,5-dien-1-one

  • Identifiers

    CAS number
    28750-52-9

    Molecular formula
    C9H12O2

    SMILES
    CC1=CC(C=C(C1=O)O)(C)C

  • Odor profile

    sweet 78.05%
    woody 47.35%
    caramellic 47.29%
    mint 44.81%
    spicy 42.05%
    tobacco 39.09%
    herbal 36.07%
    phenolic 35.04%
    burnt 32.06%
    hay 31.77%

    Scent© AI

  • Properties

    XLogP3-AA
    2.2 Well soluble in DEP, BB, MMB

    Molecular weight
    152.19 g/mol

  • Synonyms

    • Lanierone
    • 2-hydroxy-4,4,6-trimethylcyclohexa-2,5-dien-1-one
    • SCHEMBL1301789
    • GKOBUKITZSFCJC-UHFFFAOYSA-N
    • DTXSID201031959
    • 28750-52-9
    • 2-Hydroxy-4,4,6-trimethyl-2,5-cyclohexadienone
    • 2-Hydroxy-4,4,6-trimethylcyclohexa-2,5-dienone
    • 2-hydroxy-4,4,6-trimethyl-2,5-cyclohexadien-1-one
    • 4,4,6-Trimethyl-2-hydroxycyclohexa-2,5-diene-1-one
    • Q19597672
    • 2,5-Cyclohexadien-1-one, 2-hydroxy-4,4,6-trimethyl-
    • InChI=1/C9H12O2/c1-6-4-9(2,3)5-7(10)8(6)11/h4-5,10H,1-3H
1 4

Botanical

Name CAS Botanical Proportion
Saffron 2 8022-19-3 Crocus sativus L., fam. Iridaceae 3.58%