Isomenthol acetate

  • Identifiers

    CAS number
    20777-45-1

    Molecular formula
    C12H22O2

    SMILES
    C[C@H]1CC[C@H]([C@@H](C1)OC(=O)C)C(C)C
    HHHOO

    Retention indicies (RI)

    • DB5: 1306.0
  • Odor profile

    fruity 83.01%
    herbal 82.44%
    sweet 80.83%
    floral 77.65%
    mint 74.94%
    fresh 63.89%
    woody 58.42%
    cooling 54.03%
    rose 45.73%
    camphoreous 43.86%

    Scent© AI

  • Properties

    XLogP3-AA
    3.6 Well soluble in BB, DEP, IAA

    Molecular weight
    198.3 g/mol

    Vapor pressure est.

    • 0.085 hPa @ 20°C
    • 0.1308 hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    229°C

  • Synonyms

    • Isomenthol acetate
    • 20777-45-1
    • rel-(1R,2S,5S)-2-Isopropyl-5-methylcyclohexyl acetate
    • SCHEMBL23722957
    • DTXSID901020799
NaN of -Infinity
Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
No restriction
Category 2
Products applied to the axillae
No restriction Category 7B
Leave-on products applied to the hair with some hand contact
No restriction
Category 3
Products applied to the face/body using fingertips
No restriction Category 8
Products with significant anogenital exposure
No restriction
Category 4
Products related to fine fragrance
No restriction Category 9
Products with body and hand exposure, primarily rinse off
No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
No restriction Category 10A
Household care products with mostly hand contact
No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
No restriction
Category 5D
Baby Creams, baby Oils and baby talc
No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
No restriction
Category 6
Products with oral and lip exposure
No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
No restriction
Name CAS Botanical Proportion
Calamintha nepeta (Belgium) Calamintha nepeta (L.) Savi (Melissa nepeta L.), fam. Lamiaceae (Labiatae) 1.6%
Peppermint (Italy) 8 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.18%
Cornmint (Mentha arvensis) (India) 3 Shivalik 68917-18-0 Mentha arvensis (L.) var. piperascens Malinv., fam. Lamiaceae (Labiatae) 0.23%
Peppermint (Italy) 10a 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.15%
Peppermint (Italy) 10b 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.3%
Hesperozygis rhododon (Brazil) Hesperozygis rhododon Epling, fam. Lamiaceae (Labiatae) 0.1%
Cornmint (Mentha arvensis) (Cuba) 68917-18-0 Mentha arvensis (L.) var. piperascens Malinv., fam. Lamiaceae (Labiatae) 0.38%
Peppermint (Belorussia) 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.26%
Pennyroyal (Cuba) 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 0.14%
Mentha arvensis ssp. austriaca 2 Mentha arvensis L. ssp. austriaca, fam. Lamiaceae (Labiatae) 0.1%
Peppermint (Mexico) 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.8%
Peppermint (Bulgaria) 4a hydrodistilled 8006-90-4 Mentha piperita L. cultivar 'Kliment-63', fam. Lamiaceae (Labiatae) 0.2%
Peppermint (Bulgaria) 4b extracted 8006-90-4 Mentha piperita L. cultivar 'Kliment-63', fam. Lamiaceae (Labiatae) 0.2%
Peppermint (Bulgaria) 5a hydrodistilled 8006-90-4 Mentha piperita L. cultivar 'Zefir', fam. Lamiaceae (Labiatae) 2.5%
Peppermint (Bulgaria) 5b extracted 8006-90-4 Mentha piperita L. cultivar 'Zefir', fam. Lamiaceae (Labiatae) 2.3%
Calamintha nepeta (France) Calamintha nepeta (L.) Savi ssp. nepeta, fam. Lamiaceae (Labiatae) 0.1%