Butyl butyrate

  • Identifiers

    CAS mumber
    109-21-7

    Molecular formula
    C8H16O2

    SMILES
    CCCCOC(=O)CCC

    Retention indicies (RI)

    • DB5: 996.0
    • Carbowax: 1208.0

  • Properties

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

    Molecular weight
    144.21 g/mol

    Melting points

    • -133 °F (USCG, 1999)
    • -91.5 °C
    • -133 °F

    Boiling points

    • 332 °F at 760 mmHg (USCG, 1999)
    • 166.00 °C. @ 760.00 mm Hg
    • 332 °F

    Flash points

    • 128 °F (USCG, 1999)
    • 128 °F

    Solubilities

    • 0.5 mg/mL at 20 °C
    • miscible with alcohol, ether, most vegetable oils; slightly soluble in propylene glycol, water
    • 1 ml in 3 ml 70% alcohol (in ethanol)

  • Synonyms

    • Butyl butyrate
    • 109-21-7
    • Butyl butanoate
    • n-Butyl butyrate
    • Butanoic acid, butyl ester
    • Butyric Acid Butyl Ester
    • n-Butyl butanoate
    • 1-Butyl butyrate
    • N-BUTYL N-BUTYRATE
    • Butyl butylate
    • Butyric acid, butyl ester
    • Butyl n-butyrate
    • Butylbutyrate
    • Butyl butyrate (natural)
    • Butyric acid n-butyl ester
    • n-Butyl n-butanoate
    • FEMA No. 2186
    • CCRIS 6551
    • butryl butyrate
    • n-BUTYL-n-BUTYRATE
    • NSC 8458
    • EINECS 203-656-8
    • UNII-1BHV00T1M4
    • Butyl ester of butanoic acid
    • n-Butyric acid n-butyl ester
    • BRN 1747101
    • AI3-06125
    • N-BUTYL-BUTYRATE
    • n-butyric n-butyl ester
    • NSC-8458
    • BUTYL BUTYRATE [FCC]
    • BUTYL BUTYRATE [FHFI]
    • 1BHV00T1M4
    • DTXSID7041702
    • CHEBI:87429
    • N-BUTYL N-BUTYRATE [MI]
    • 4-02-00-00789 (Beilstein Handbook Reference)
    • WE(4:0/4:0)
    • butanoic acid butyl ester
    • butylbutanoate
    • nButyl butyrate
    • nButyl butanoate
    • 1Butyl butyrate
    • MFCD00009450
    • Butyl butyrate, 98%
    • Butyric acid-butyl ester
    • WLN: 4OV3
    • SCHEMBL113994
    • DTXCID5021702
    • FEMA 2186
    • NSC8458
    • Butyl butyrate, analytical standard
    • AAA10921
    • LMFA07010418
    • Butyl butyrate, >=98%, FCC, FG
    • AKOS009165857
    • LS-13508
    • DB-003606
    • B0757
    • Butyl butyrate, natural, >=98%, FCC, FG
    • NS00012028
    • EN300-52980
    • A801979
    • Q2212471
    • 203-656-8
1 3

Botanical

Name CAS Botanical Proportion
Lavender (France) 2a 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix), fam. Lamiaceae 0.06%
Myrtle berry (Italy) 8008-46-6 Myrtus communis L., fam. Myrtaceae 0.05%
Lavender (USA) (var. Loddon pink) 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix) (Loddon pink cultivar) 0.11%
Lavender (USA) (var. Jean Davis) 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix) (Jean Davis cultivar) 0.26%
Lavender (USA) (var. Rosea) 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix) (Rosea cultivar) 0.26%
Osmanthus concentrate 2 (Sukhumi-Abkhasia) 68917-05-5 Osmanthus fragrans (Thunb.) Lour., fam. Oleaceae 0.02%
Orange, sweet (Japan) (oxygenated compounds) 8028-48-6 Citrus sinensis (L.) Osbeck, cultivar Fukuhara, fam. Rutaceae 0.1%
Lavender (France) 6 8000-28-0 Lavandula angustifolia Mill., fam. Lamiaceae (Labiatae) 0.25%
Mandrake fruit (Israel) Mandragora officinarum L., fam. Solanaceae 2.44%
Lavandin (France) (Grosso) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiesleur), Lamiaceae 0.04%
Lavandin (France) (Abrialis) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiseleur), Lamiaceae 0.03%
Genet headspace 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.01%
Artabotrys hexapetalus flower headspace (China) Artabotrys hexapetalus (L.) f. Bhandari, fam. Annonaceae 0.1%
Averrhoa bilimbi fruit (Malaysia) Averrhoa bilimbi L., fam. Oxalidaceae 0.2%
Roman chamomile (Italy) 6 8015-92-7 Anthemis nobilis L., fam. Asteraceae (Compositae) 0.85%
Carob bean extract 1 9000-40-2 Ceratonia siliqua L., fam. Leguminoseae 0.01%
Parsnip (Germany) 2d green fruit 90082-39-6 Pastinaca sativa L., fam. Apiaceae (Umbelliferae) 0.98%
Parsnip (USA) fruit 90082-39-6 Pastinaca sativa L., fam. Apiaceae (Umbelliferae) 0.6%
Parsnip (Germany) 3a wild fruit 90082-39-6 Pastinaca sativa L., fam. Apiaceae (Umbelliferae) 0.65%
Parsnip (Germany) 3b cultivated fruit 90082-39-6 Pastinaca sativa L., fam. Apiaceae (Umbelliferae) 1.6%
Parsnip (Germany) 3c botanic garden fruit 90082-39-6 Pastinava sativa L., fam. Apiaceae (Umbelliferae) 0.1%
Osage orange fruit, 1a headspace Maclura pomifera (Raf.) Schneid, fam. Moraceae 0.3%