3,5,5-Trimethyl-4-methylene-2-cyclohexen-1-one

  • Identifiers

    CAS number
    20548-00-9

    Molecular formula
    C10H14O

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

  • Odor profile

    woody 73.22%
    sweet 65.6%
    fruity 64.84%
    tobacco 61.5%
    mint 60.49%
    camphoreous 49.95%
    herbal 45.04%
    spicy 42.43%
    green 41.61%
    tea 37.92%

    Scent© AI

  • Properties

    XLogP3-AA
    1.7 Well soluble in DEP, MMB, TEC

    Molecular weight
    150.22 g/mol

  • Synonyms

    • 4-Methyleneisophorone
    • 2-cyclohexen-1-one, 3,5,5-trimethyl-4-methylene-
    • Methyleneisophorone
    • D5MU2X8KSH
    • 20548-00-9
    • UNII-D5MU2X8KSH
    • Isophorone-4-methylene
    • 3,5,5-trimethyl-4-methylenecyclohex-2-en-1-one
    • 4-Methylene-3,5,5-trimethyl-2-cyclohexen-1-one
    • 3,5,5-Trimethyl-4-methylene-1-cyclohexanon-2-ene
    • DTXSID10348889
    • 3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-one
    • 3,5,5-Trimethyl-4-methylenecyclohex-2-enone
    • 4-methylene-3,5,5-trimethylcyclohex-2-enone
    • SCHEMBL11607730
    • DTXCID90299961
    • Q67879615
1 4

Botanical

Name CAS Botanical Proportion
Saffron 1 8022-19-3 Crocus sativus L., fam. Iridaceae 0.1%
Saffron 2 8022-19-3 Crocus sativus L., fam. Iridaceae 0.01%