Propyl isovalerate

  • Identifiers

    CAS mumber
    557-00-6

    Molecular formula
    C8H16O2

    SMILES
    CCCOC(=O)CC(C)C

    Retention indicies (RI)

    • Carbowax: 1144.0

  • Properties

    XLogP3-AA
    2.3 Well soluble in DEP, BB, MMB

    Molecular weight
    144.21 g/mol

    Boiling points

    • 156.00 to 157.00 °C. @ 760.00 mm Hg

    Solubilities

    • soluble in organic solvents, alcohol; insoluble in water

  • Synonyms

    • PROPYL ISOVALERATE
    • Propyl 3-methylbutanoate
    • 557-00-6
    • Butanoic acid, 3-methyl-, propyl ester
    • Propyl isopentanoate
    • Isovaleric acid, propyl ester
    • Propyl 3-methylbutyrate
    • Propyl isovalerianate
    • FEMA No. 2960
    • Propyl isovalerate (natural)
    • EINECS 209-148-2
    • n-Propyl iso-valerate
    • UNII-802KM69CKR
    • BRN 1747146
    • 802KM69CKR
    • AI3-33613
    • 3-Methylbutanoic acid, propyl ester
    • FEMA 2960
    • PROPYL ISOVALERATE [FHFI]
    • DTXSID70204230
    • Butanoic acid, 3-methyl-, propyl ester (9CI)
    • n-Propyl methylbutyrate
    • Propyl 3-methylbutanoate #
    • Propyl 3-methylbutanoic acid
    • SCHEMBL133737
    • CHEBI:89725
    • 3-methylbutyric acid propyl ester
    • DTXCID70126721
    • 3-methylbutanoic acid propyl ester
    • LMFA07011003
    • AKOS008947870
    • DB-024214
    • CS-0453597
    • NS00022372
    • Propyl isovalerate, natural (US), >=98%, FG
    • Q27161915
    • 209-148-2
1 3

Botanical

Name CAS Botanical Proportion
Artemisia judaica (Israel) 2 Artemisia judaica L. (Bat'aran), fam. Asteraceae (Compositae) 0.3%