• Identifiers

    CAS number
    10471-96-2

    Molecular formula
    C15H26O2

    SMILES
    CCCCC(=O)OC(C)(CCC=C(C)C)C=C
    OO

    Retention indicies (RI)

    • Carbowax: 1765.0
  • Odor profile

    fruity 87.79%
    sweet 62.37%
    floral 58.9%
    rose 54.16%
    herbal 50.58%
    citrus 48.3%
    bergamot 46.26%
    pear 44.54%
    woody 42.64%
    pineapple 41.84%

    Scent© AI

  • Properties

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

    Molecular weight
    238.37 g/mol

  • Synonyms

    • Linalyl valerate
    • 10471-96-2
    • 1,5-Dimethyl-1-vinylhex-4-enyl valerate
    • Linalyl pentanoate
    • UNII-HA76KNF2JB
    • HA76KNF2JB
    • 3,7-dimethylocta-1,6-dien-3-yl pentanoate
    • Linalyl N-valerate
    • Pentanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester
    • Pentanoic acid, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester
NaN of -Infinity
Name CAS Botanical Proportion
Pennyroyal 4 8013-99-8 Mentha pulegium L., fam. Lamiaceae (Labiatae) 1.3%