Hexyl 2-methylbutanoate

  • Identifiers

    CAS mumber
    10032-15-2

    Molecular formula
    C11H22O2

    SMILES
    CCCCCCOC(=O)C(C)CC

    Retention indicies (RI)

    • DB5: 1237.0
    • Carbowax: 1429.0

  • Properties

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

    Molecular weight
    186.29 g/mol

    Boiling points

    • 105.00 °C. @ 30.00 mm Hg

    Solubilities

    • very slightly
    • soluble in alcohol, most fixed oils; insoluble in water

  • Synonyms

    • Hexyl 2-methylbutanoate
    • Hexyl 2-methylbutyrate
    • 10032-15-2
    • Butanoic acid, 2-methyl-, hexyl ester
    • BUTYRIC ACID, 2-METHYL-, HEXYL ESTER
    • FEMA No. 3499
    • 2-Methylbutanoic acid, n-hexyl ester
    • Hexyl 2-methylbutanoate (natural)
    • EINECS 233-106-2
    • UI17LL5Q4P
    • BRN 1856407
    • DTXSID4047599
    • AI3-33623
    • n-Hexyl 2-methylbutanoate
    • n-Hexyl 2-methyl butyrate
    • DTXCID2027599
    • N-HEXYL 2-METHYLBUTYRATE
    • HEXYL 2-METHYLBUTYRATE [FCC]
    • HEXYL 2-METHYLBUTYRATE [FHFI]
    • hexyl 2-methyl butyrate
    • exyl 2-methylbutanoate
    • UNII-UI17LL5Q4P
    • HEXYL-2-METHYLBUTYRATE
    • Hexyl 2-methylbutanoate #
    • SCHEMBL573736
    • CHEMBL3561573
    • FEMA 3499
    • CHEBI:156491
    • Tox21_302599
    • LMFA07010906
    • MFCD00048880
    • AKOS015903802
    • NCGC00256766-01
    • AS-76706
    • CAS-10032-15-2
    • CS-0439610
    • H1788
    • Hexyl 2-methylbutanoate, >=95%, FCC, FG
    • NS00012614
    • F86955
    • Hexyl 2-methylbutanoate, analytical reference material
    • Q27291087
    • 233-106-2
1 3

Botanical

Name CAS Botanical Proportion
Lemon verbena (Morocco) 1 Aloysia triphylla (L'Herit.) Britton (Lippia citriodora (Lam.) O. Kuntze) 0.3%
Lavandin (France) (Grosso) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiesleur), Lamiaceae 0.05%
Lavandin (France) (Abrialis) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiseleur), Lamiaceae 0.12%
Spike lavender 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.06%
Spike lavender (Spain) 5 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.42%
Spike lavender (Iran) 1a fresh 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.2%
Spike lavender (Iran) 1b dry 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.2%
Heracleum persicum (Iran) 1c flower Heracleum persicum L., fam. Apiaceae (Umbelliferae) 0.5%
Tordylium pustulosum fruit (Turkey) Tordylium pustulosum Boiss., fam. Apiaceae (Umbelliferae) 0.3%
Lavandin (Hvar) 8022-15-9 Lavandula x hybrida 0.44%