• Identifiers

    CAS mumber
    66576-71-4

    Molecular formula
    C8H16O2

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

  • Odor profile @Scent© AI

    Odor Probability
    fruity 97.7%
    apple 73.16%
    sweet 64.32%
    pineapple 63.16%
    green 61.26%
    banana 58.18%
    tropical 57.76%
    ethereal 53.42%
    ripe 44.33%
    berry 43.7%
  • Properties

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

    Molecular weight
    144.21 g/mol

    Boiling points

    • 140.00 to 144.00 °C. @ 727.00 mm Hg

    Solubilities

    • insoluble in water
    • soluble (in ethanol)

  • Synonyms

    • Isopropyl 2-methylbutyrate
    • 66576-71-4
    • Isopropyl 2-methylbutanoate
    • propan-2-yl 2-methylbutanoate
    • FEMA 3699
    • Butanoic acid, 2-methyl-, 1-methylethyl ester
    • FEMA No. 3699
    • 1-Methylethyl 2-methylbutanoate
    • Isopropyl 2-methyIbutyrate
    • 2-Propyl 2-methylbutanoate
    • isopropyl 2-methyl butyrate
    • UNII-3429OS9G6T
    • 3429OS9G6T
    • EINECS 266-411-4
    • AI3-33626
    • DTXSID3047550
    • 2-METHYLBUTANOIC ACID 1-METHYLETHYL ESTER
    • ISOPROPYL 2-METHYLBUTYRATE [FHFI]
    • (+/-)-ISOPROPYL 2-METHYLBUTYRATE
    • ISOPROPYL 2-METHYLBUTYRATE, (+/-)-
    • 2-Methylbutyric Acid Isopropyl Ester
    • MFCD00085203
    • starbld0009590
    • Fema3699
    • Isopropyl-2-methylbutanoat
    • SCHEMBL580557
    • Isopropyl 2-methylbutanoic acid
    • DTXCID1027550
    • CHEBI:179936
    • Isopropyl 2-methylbutyrate, >=98%
    • LMFA07010920
    • AKOS009117978
    • CS-0365151
    • I0736
    • NS00019574
    • Q27256322
    • 266-411-4
1 of 4
Name CAS Botanical Proportion
Laurel leaf (Turkey) 4 8006-78-8 Laurus nobilis L., fam. Lauraceae 0.01%
Peppermint (Mexico) 8006-90-4 Mentha piperita L., fam. Lamiaceae (Labiatae) 0.1%