1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-acetate, (3S,6Z)-

  • Identifiers

    CAS number
    56001-43-5

    Molecular formula
    C17H28O2

    SMILES
    CC(=CCC/C(=C\CC[C@@](C)(C=C)OC(=O)C)/C)C
    OO

    Retention indicies (RI)

    • DB5: 1713.0
  • Odor profile

    floral 83.57%
    sweet 71.35%
    citrus 68.94%
    woody 66.7%
    fresh 58.8%
    green 57.87%
    rose 52.46%
    fruity 52.28%
    bergamot 51.48%
    waxy 50.3%

    Scent© AI

  • Properties

    XLogP3-AA
    5.2 Well soluble in BB, IPM, DOA

    Molecular weight
    264.4 g/mol

    Vapor pressure est.

    • 0.0004 hPa @ 20°C
    • 0.0007 hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    290°C

  • Synonyms

    • EINECS 259-941-2
    • 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, acetate, (3S,6Z)-
    • 56001-43-5
    • (S-(Z))-3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol, acetate
    • 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-acetate, (3S,6Z)-
    • (+-)-Nerolidyl acetate
    • [(3S,6Z)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl] acetate
    • SCHEMBL15914304
    • PRNJXUQTUSFYLV-MLRPBERTSA-N
    • DTXSID501009866
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
Narcissus poeticus absolute 8023-75-4 Narcissus poeticus L., fam. Amaryllidaceae 0.1%
Inula viscosa (Turkey) Inula viscosa (L.) Aiton (Dittrichia viscosa (L.) Greuter), fam.Asteraceae 0.5%
Rollinia mucosa fruit Rollinia mucosa (Jacq.) Baill, fam. Annonaceae 3.6%
Geranium (Cuba) 8000-46-2 Pelargonium species, fam. Geraniaceae 1.3%
Schizogyne glaberrima (Spain/Canary Islands) Schizogyne glaberrima DC., fam. Asteraceae (Compositae) 0.1%
Lavender (France) 8 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix), fam. Lamiaceae 0.01%
Lavender (Ukraine) 8000-28-0 Lavandula angustifolia Mill., (L. officinalis Chaix), fam. Lamiaceae 0.02%