• Identifiers

    CAS number
    2306-88-9

    Molecular formula
    C16H32O2

    SMILES
    CCCCCCCCOC(=O)CCCCCCC
    OO

    Retention indicies (RI)

    • Carbowax: 2020.0
  • Odor profile

    fruity 77.83%
    oily 74.47%
    fatty 65.31%
    winey 61.44%
    floral 57.37%
    waxy 56.85%
    cognac 55.12%
    sweet 49.11%
    green 48.42%
    rose 45.83%

    Scent© AI

  • Properties

    XLogP3-AA
    6.5 Well soluble in IPM, DOA, IPP

    Molecular weight
    256.42 g/mol

    Vapor pressure est.

    • 0.0001 hPa @ 20°C
    • 0.0002 hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    310°C

    Melting point expt.

    • -18.1 °C

    Boiling point expt.

    • 306.00 to 307.00 °C. @ 760.00 mm Hg

    Solubility expt.

    • soluble in alcohol; insoluble in water

  • Synonyms

    • Octyl octanoate
    • Octyl caprylate
    • 2306-88-9
    • Octanoic acid, octyl ester
    • n-Octyl caprylate
    • Octyl octylate
    • caprylyl caprylate
    • Fema 2811
    • UNII-MM00XO86JQ
    • MM00XO86JQ
NaN of -Infinity
Name CAS Botanical Proportion
Zosima absinthifolia fruit Zosima absinthifolia (Vent.) Link, fam. Apiaceae (Umbelliferae) 6.0%
Tordylium apulum fruit (Turkey) Tordylium apulum L., fam. Apiaceae (Umbelliferae) 34.5%
Tordylium pustulosum fruit (Turkey) Tordylium pustulosum Boiss., fam. Apiaceae (Umbelliferae) 0.7%