3,4,5-Trimethoxytoluene

  • Identifiers

    CAS number
    6443-69-2

    Molecular formula
    C10H14O3

    SMILES
    CC1=CC(=C(C(=C1)OC)OC)OC
    OOO

  • Odor profile

    spicy 66.65%
    phenolic 59.76%
    woody 57.35%
    smoky 48.84%
    vanilla 42.1%
    floral 35.61%
    leathery 35.24%
    earthy 35.22%
    burnt 35.04%
    balsamic 33.08%

    Scent© AI

  • Properties

    XLogP3-AA
    1.8 Well soluble in IAA, DEP, MMB

    Molecular weight
    182.22 g/mol

    Vapor pressure est.

    • 0.0075 hPa @ 20°C
    • 0.0124 hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    261°C

  • Synonyms

    • 3,4,5-Trimethoxytoluene
    • 6443-69-2
    • 1,2,3-Trimethoxy-5-methylbenzene
    • Benzene, 1,2,3-trimethoxy-5-methyl-
    • Toluene, 3,4,5-trimethoxy-
    • EINECS 229-239-0
    • MFCD00008397
    • CHEMBL156710
    • CHEBI:81354
    • DTXSID80214683
NaN -Infinity

IFRA Standard 51

Recommendation
No restriction

Botanical

Name CAS Botanical Proportion
Minthostachys spicata Minthostachys spicata (Benth.) Epl., fam Lamiaceae (Labiatae) 12.4%