Pentyl hexanoate

  • Identifiers

    CAS mumber
    540-07-8

    Molecular formula
    C11H22O2

    SMILES
    CCCCCC(=O)OCCCCC

    Retention indicies (RI)

    • Carbowax: 1502.0

  • Properties

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

    Molecular weight
    186.29 g/mol

    Melting points

    • -47 °C

    Solubilities

    • soluble in alcohol, propylene glycol, fixed oils: insoluble in glycerol, water
    • 1 ml in 1 ml 80% alcohol (in ethanol)

  • Synonyms

    • PENTYL HEXANOATE
    • Amyl hexanoate
    • 540-07-8
    • Amyl caproate
    • n-Amyl caproate
    • Hexanoic acid, pentyl ester
    • Amyl capronate
    • Pentyl caproate
    • Amyl hexoate
    • valeryl hexanoate
    • Amyl hexanoate (natural)
    • n-Amyl n-hexanoate
    • Hexanoic Acid Pentyl Ester
    • FEMA No. 2074
    • Pentyl ester hexanoic acid
    • EINECS 208-732-4
    • UNII-5M61M1AL1H
    • NSC 46119
    • BRN 1760251
    • 5M61M1AL1H
    • DTXSID0047581
    • AI3-06030
    • NSC-46119
    • AMYL HEXANOATE [FHFI]
    • N-AMYL CAPROATE [MI]
    • DTXCID8027581
    • FEMA 2074
    • WE(5:0/6:0)
    • n-Caproic acid n-amyl ester
    • Pentyl hexanoic acid
    • MFCD00027281
    • Valeryl hexanoic acid
    • Hexanoic Acid Amyl Ester
    • SCHEMBL333234
    • Amyl hexanoate, >=98%, FG
    • CHEMBL3187784
    • CHEBI:179383
    • Amyl hexanoate, analytical standard
    • NSC46119
    • NSC53794
    • Tox21_302698
    • LMFA07010437
    • NSC-53794
    • AKOS024319273
    • NCGC00256827-01
    • CAS-540-07-8
    • DB-052452
    • CS-0362574
    • H0106
    • NS00011971
    • Q7165332
1 3

Botanical

Name CAS Botanical Proportion
Palmarosa (India) 4 8014-19-5 Cymbopogon martini (Roxb.) Wats, var. martini, fam. Poaceae (Gramineae) 0.3%
Palmarosa (India) 1 8014-19-5 Cymbopogon martini (Roxb.) Wats, var. martini, fam. Poaceae (Gramineae) 0.05%
Osage orange fruit, 1a headspace Maclura pomifera (Raf.) Schneid, fam. Moraceae 0.8%
Soursop, wild fruit Annona montana Macf., fam. Annonaceae 0.1%