Hexyl acetate

  • Identifiers

    CAS mumber
    142-92-7

    Molecular formula
    C8H16O2

    SMILES
    CCCCCCOC(=O)C

    Retention indicies (RI)

    • DB5: 1015.0
    • Carbowax: 1279.71

  • Properties

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

    Molecular weight
    144.21 g/mol

    Melting points

    • -112 °F (USCG, 1999)
    • -80.9 °C
    • -81 °C

    Boiling points

    • 334.4 to 338 °F at 760 mmHg (USCG, 1999)
    • 171.5 °C
    • 170.00 to 172.00 °C. @ 760.00 mm Hg

    Flash points

    • 99 °F (USCG, 1999)
    • 45 °C
    • 113 °F (45 °C) (Closed cup)

    Solubilities

    • Very soluble in alcohol and ether
    • In water, 511 mg/L at 25 °C
    • 0.511 mg/mL at 25 °C
    • soluble in alcohol, ether; insoluble in water
    • 1 ml in 1 ml 95% alcohol (in ethanol)

  • Synonyms

    • Hexyl acetate
    • 142-92-7
    • n-Hexyl acetate
    • ACETIC ACID, HEXYL ESTER
    • Hexyl ethanoate
    • 1-Hexyl acetate
    • Acetic Acid Hexyl Ester
    • n-Hexyl ethanoate
    • Hexyl alcohol, acetate
    • l-Hexyl acetate
    • FEMA No. 2565
    • HSDB 5641
    • Hexylester kyseliny octove
    • Acetic acid n-hexyl ester
    • UNII-7U7KU3MWT0
    • Hexyl ester of acetic acid
    • NSC 7323
    • EINECS 205-572-7
    • BRN 1747138
    • DTXSID6022006
    • CHEBI:87510
    • AI3-28569
    • acidic acid hexyl ester
    • NSC-7323
    • MFCD00009524
    • Acetic acid, n-hexyl ester
    • HEXYL ACETATE [FCC]
    • 7U7KU3MWT0
    • EXCEED 600
    • HEXYL ACETATE [FHFI]
    • HEXYL ESTER ACETIC ACID
    • DTXCID602006
    • EC 205-572-7
    • 4-02-00-00159 (Beilstein Handbook Reference)
    • ACETIC ACID, HEXYL ESTER [HSDB]
    • Hexyl acetate (natural)
    • HEXYL ACETATE, (FLAMMABLE LIQUID LABEL)
    • HEXYL ACETATE, [FLAMMABLE LIQUID LABEL]
    • Hexylester kyseliny octove [Czech]
    • HEXYL ACETATE, (COMBUSTIBLE LIQUID LABEL)
    • HEXYL ACETATE, [COMBUSTIBLE LIQUID LABEL]
    • nHexyl acetate
    • nHexyl ethanoate
    • 1Hexyl acetate
    • Acetate C6
    • Hexyl acetate, 99%
    • Acetic acid-hexyl ester
    • N- HEXYL ACETATE
    • DSSTox_CID_2006
    • EC 421-230-1
    • DSSTox_RID_78665
    • DSSTox_GSID_29061
    • FEMA NUMBER 2565
    • SCHEMBL94650
    • HEXYL ACETATE [INCI]
    • WLN: 6OV1
    • CHEMBL2228454
    • FEMA 2565
    • NSC7323
    • Hexyl acetate, analytical standard
    • Tox21_200711
    • Tox21_301393
    • LMFA07010184
    • Hexyl acetate, >=98%, FCC, FG
    • AKOS015907932
    • NCGC00248805-01
    • NCGC00255245-01
    • NCGC00258265-01
    • CAS-142-92-7
    • FH175244
    • LS-13519
    • CAS-88230-35-7
    • A0032
    • Hexyl acetate, natural, >=98%, FCC, FG
    • NS00003895
    • A807984
    • Q418672
    • 205-572-7
1 3

Botanical

Name CAS Botanical Proportion
Bergamot (China) 5 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.01%
Bergamot (China) 2 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.02%
Bergamot (China) 3 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.16%
Bergamot (China) 4 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.11%
Roman chamomile (Italy) 1 8015-92-7 Anthemis nobilis L., fam. Asteraceae (Compositae) 5.0%
Narcissus tazetta absolute 2 8023-75-4 Narcissus tazetta L., fam. Amaryllidaceae 0.1%
Olibanum, Frankincense (Eritrea) 8016-36-2 Boswellia carterii Birdwood, fam. Burseraceae 0.25%
Rose (Bulgaria) 1 8007-01-0 Rosa damascena Mill., fam. Rosaceae 0.01%
Rose (Turkey) 1 8007-01-0 Rosa damascena Mill., fam. Rosaceae 0.01%
Spike lavender (Spain) 2 8016-78-2 Lavandula latifolia Medikus (L. spica D.C.), fam. Lamiaceae (Labiatae) 0.05%
Rosa chinensis (headspace), China Rosa chinensis Jacq., fam. Rosaceae 3.95%
Etrog, peel Citrus medica L., cultivar ethrog Engl., fam. Rutaceae 0.01%
Guava fruit (Egypt) 91770-12-6 Psidium guajava L., fam. Myrtaceae 1.1%
Olibanum, Frankincense (Somalia) 1 8016-36-2 Boswellia carterii Birdwood, fam. Burseraceae 0.1%
Olibanum, Frankincense (Egypt) 8016-36-2 Boswellia carterii Birdwood, fam. Burseraceae 0.13%
Lavender (France) 6 8000-28-0 Lavandula angustifolia Mill., fam. Lamiaceae (Labiatae) 0.55%
Pear (Japan), Asian Pyrus serotina Rehder (Asian pear), cultivar Chojui, fam. Rosaceae 0.01%
Mandrake fruit (Israel) Mandragora officinarum L., fam. Solanaceae 6.94%
Rose headspace 1 8007-01-0 Rosa damascena Mill., cv. Othello, fam. Rosaceae 0.3%
Lavandin (Italy) 1 (Grosso) 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiseleur), Lamiaceae 0.5%
Rhus coriaria Rhus coriaria L., fam. Anarcadiaceae 0.01%
Valerian, Living Flowers Valeriana officinalis L., fam. Valerianaceae 1.59%
Valerian, Picked Flowers Valeriana officinalis L., fam. Valerianaceae 0.36%
Valerian, Flower Valeriana officinalis L., fam. Valerianaceae 1.87%
Chamomile, german (Germany) 2, Living Flower 8002-66-2 Chamomilla recutita (L.) Rausch.(Matricaria chamomilla L.), fam.Asteraceae 0.23%
Hyacinth, picked flower headspace 1b Hyacinthus orientalis L., fam. Liliaceae 0.01%
Orange, sweet (USA) (hydrocarbon-free) 8028-48-6 Citrus sinensis (L.) Osbeck, fam. Rutaceae 0.06%
Lavandin (France) (Grosso) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiesleur), Lamiaceae 0.17%
Lavandin (France) (Abrialis) 2 8022-15-9 Lavandula x hybrida Rev. (L. x intermedia Emeric ex Loiseleur), Lamiaceae 0.24%
Chaenomeles speciosa (Flowering Quince) Chaenameles speciosa Nakai, fam. Rosaceae 0.21%
Jasmine rose flower headspace (China) 1 Gardenia jasminoides Ellis, fam. Rubiaceae 0.03%
Guava fruit headspace (China) 91770-12-6 Psidium guajava L., fam. Myrtaceae 1.32%
Ylang Ylang 5a 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 0.22%
Ylang Ylang 5c 8006-81-3 Cananga odorata (Lamk.) Hook. f. et Thomson forma genuina, fam. Annonaceae 0.01%
Lavender (Italy) 1a 8000-28-0 Lavandula angustifolia Mill. (L. officnalis Chaix), fam. Lamiaceae 0.15%
Lavender (Italy) 1b 8000-28-0 Lavandula angustifolia Mill. (L. officinalis Chaix), fam. Lamiaceae 0.15%
Ambarella fruit Spondias cytherea Sonnerat (Ambarella), fam. Anacardiaceae 0.17%
Acacia confusa flower (China) Acacia confusa Merr., fam. Mimosaceae (Leguminosae) 0.1%
Bergamot (Italy) 4 8007-75-8 Citrus bergamia Risso et Poiteau, fam. Rutaceae 0.01%
Lavender (Lithuania) 8000-28-0 Lavandula angustifolia Mill., fam. Lamiaceae (Labiatae) 1.96%
Olive flower (headspace) Olea europaea L., fam. Oleaceae 1.2%
Narcissus tazetta (var. chinensis) headspace 8023-75-4 Narcissus tazetta L., var. chinensis, fam. Amarillidaceae 0.07%
Neroli bigarade (bitter orange flower) Spain 3 8016-38-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.03%
Neroli bigarade (bitter orange flower) Tunisia 2 8016-38-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.05%
Neroli bigarade (bitter orange flower) Morocco 8016-38-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.04%
Rosa rugosa (China) 1 Rosa rugosa Thunb. (hybrids), fam. Rosaceae 0.01%
Tulip sylvestre Tulipa sylvestris L., fam. Liliaceae 0.02%
Olibanum, African (Oman) 8016-36-2 Boswellia frereana Birdwood, fam. Burseraceae 0.01%
Psidium cattleianum fruit (R‚union Island) Psidium cattleianum Sabine, fam. Myrtaceae 1.0%
Myrtle flower (Albania) 8008-46-6 Myrtus communis L., fam. Myrtaceae 0.34%