Benzyl octanoate

  • Identifiers

    CAS number
    10276-85-4

    Molecular formula
    C15H22O2

    SMILES
    CCCCCCCC(=O)OCC1=CC=CC=C1

    Retention indicies (RI)

    • Carbowax: 2260.0

  • Odor profile

    fruity 73.29%
    floral 62.52%
    sweet 59.16%
    oily 55.13%
    fatty 54.44%
    herbal 53.86%
    winey 52.99%
    waxy 51.96%
    green 50.58%
    balsamic 43.22%

    Scent© AI

  • Properties

    XLogP3-AA
    4.6 Well soluble in BB, DEP, IPM

    Molecular weight
    234.33 g/mol

  • Synonyms

    • Benzyl octanoate
    • 10276-85-4
    • Benzyl caprylate
    • Octanoic acid, phenylmethyl ester
    • Octanoic acid, benzyl ester
    • Benzyl n-octanoate
    • EINECS 233-620-7
    • AI3-30977
    • DTXSID30145493
    • NSC 23754
    • MFCD00048914
    • octanoic acid benzyl ester
    • SCHEMBL872955
    • DTXCID9067984
    • KAA27685
    • NSC23754
    • NSC-23754
    • B6116
    • NS00012010
    • D95233
    • Q63409798
    • 233-620-7
1 4

Botanical

Name CAS Botanical Proportion
Massoia bark Cryptocaryo massoia, fam. Lauraceae 0.01%
Hedychium coronarium flower (Japan) Hedychium coronarium Koenig, fam. Zingiberaceae 0.03%