3-Buten-1-ol, 1-acetate

Overview IFRA Request a quote

  • Identifiers

    CAS number
    1576-84-7

    Molecular formula
    C6H10O2

    SMILES
    CC(=O)OCCC=C

    Safety labels

    Corrosive
    Corrosive

    Irritant
    Irritant

  • Odor profile

    Fragrance
    Fruity 94.58%
    Green 72.59%
    Ethereal 64.75%
    Pungent 52.71%
    Sharp 49.65%
    Rummy 47.72%
    Sweet 43.97%
    Apple 43.12%
    Fresh 41.44%
    Banana 39.67%

     

    Flavor
    Fruity 79.86%
    Ethereal 50.01%
    Green 47.23%
    Sweet 44.36%
    Fresh 41.6%
    Bitter 36.33%
    Banana 34.03%
    Apple 33.14%
    Pungent 33.02%
    Tropical 32.2%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    1.2

    pKa est.
    7.99 (neutral)

    Molecular weight
    114.14 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    128°C

    Flash point

    • 34.46 ˚C est.

  • Synonyms

    • 3-Butenyl acetate
    • 1576-84-7
    • 3-Buten-1-ol, 1-acetate
    • 3-Buten-1-ol, acetate
    • NSC 157648
    • DTXSID60883699
    • CH3C(O)O(CH2)2CH=CH2
    • RefChem:93277
    • DTXCID901023200
    • IEKXSSZASGLISC-UHFFFAOYSA-N
    • Acetic Acid 3-Buten-1-Yl Ester
    • but-3-enyl acetate
    • 2-Vinylethyl acetate
    • but-3-en-1-yl acetate
    • 3-Buten-1-ol acetate
    • MFCD00086596
    • 3-buten-1-yl acetate
    • CNC9Y3RL85
    • NSC-157648
    • 4-Acetoxy-1-butene
    • Acetic Acid 3-Butenyl Ester
    • ACETICACID3-BUTEN-1-YLESTER
    • UNII-CNC9Y3RL85
    • Aceticacid 3-buten-1-ylester
    • SCHEMBL506184
    • QSPL 005
    • SCHEMBL6723047
    • SCHEMBL9858740
    • NSC157648
    • AKOS006230193
    • SY053618
    • B1737
    • CS-0206024
    • F470195
    • 1576-84-7

  • Applications

    3-Buten-1-ol, 1-acetate (CAS 1576-84-7) is commonly used as a synthetic building block and processing aid across multiple industries. In perfumery and flavor applications, it may function as a fragrance intermediate or odorant; in coatings, inks, and adhesives, it serves as a solvent and processing additive; its allyl functionality enables it to act as a reactive monomer or crosslinking component in polymer and resin formulations; it can also serve as a plasticizer or processing solvent for certain polymers; and more broadly it is used as an intermediate to prepare allyl-containing specialty chemicals.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 390.49
    methanol 587.01
    isopropanol 294.11
    water 15.0
    ethyl acetate 133.0
    n-propanol 233.76
    acetone 251.95
    n-butanol 227.91
    acetonitrile 243.53
    DMF 466.29
    toluene 56.73
    isobutanol 169.16
    1,4-dioxane 379.68
    methyl acetate 155.89
    THF 409.18
    2-butanone 147.67
    n-pentanol 143.79
    sec-butanol 202.59
    n-hexane 33.33
    ethylene glycol 131.52
    NMP 474.81
    cyclohexane 50.45
    DMSO 402.77
    n-butyl acetate 74.95
    n-octanol 108.23
    chloroform 337.23
    n-propyl acetate 70.48
    acetic acid 447.85
    dichloromethane 331.66
    cyclohexanone 239.3
    propylene glycol 155.04
    isopropyl acetate 71.66
    DMAc 442.07
    2-ethoxyethanol 203.83
    isopentanol 152.99
    n-heptane 22.59
    ethyl formate 125.04
    1,2-dichloroethane 143.21
    n-hexanol 137.19
    2-methoxyethanol 388.69
    isobutyl acetate 45.98
    tetrachloromethane 45.38
    n-pentyl acetate 66.59
    transcutol 609.4
    n-heptanol 61.08
    ethylbenzene 45.08
    MIBK 67.54
    2-propoxyethanol 198.6
    tert-butanol 291.65
    MTBE 130.26
    2-butoxyethanol 105.35
    propionic acid 243.46
    o-xylene 61.34
    formic acid 184.92
    diethyl ether 133.07
    m-xylene 46.52
    p-xylene 63.4
    chlorobenzene 84.85
    dimethyl carbonate 54.34
    n-octane 10.33
    formamide 197.56
    cyclopentanone 267.23
    2-pentanone 113.31
    anisole 107.74
    cyclopentyl methyl ether 155.08
    gamma-butyrolactone 322.39
    1-methoxy-2-propanol 257.69
    pyridine 196.92
    3-pentanone 94.7
    furfural 300.94
    n-dodecane 12.18
    diethylene glycol 186.48
    diisopropyl ether 36.33
    tert-amyl alcohol 230.57
    acetylacetone 132.74
    n-hexadecane 13.08
    acetophenone 98.32
    methyl propionate 118.75
    isopentyl acetate 66.9
    trichloroethylene 258.02
    n-nonanol 92.96
    cyclohexanol 211.24
    benzyl alcohol 106.78
    2-ethylhexanol 80.8
    isooctanol 49.61
    dipropyl ether 73.92
    1,2-dichlorobenzene 87.86
    ethyl lactate 66.47
    propylene carbonate 159.23
    n-methylformamide 220.37
    2-pentanol 134.09
    n-pentane 32.5
    1-propoxy-2-propanol 138.2
    1-methoxy-2-propyl acetate 89.07
    2-(2-methoxypropoxy) propanol 182.89
    mesitylene 32.36
    ε-caprolactone 210.65
    p-cymene 35.09
    epichlorohydrin 256.52
    1,1,1-trichloroethane 135.81
    2-aminoethanol 207.99
    morpholine-4-carbaldehyde 408.5
    sulfolane 355.89
    2,2,4-trimethylpentane 17.7
    2-methyltetrahydrofuran 266.44
    n-hexyl acetate 136.4
    isooctane 9.68
    2-(2-butoxyethoxy)ethanol 224.01
    sec-butyl acetate 49.42
    tert-butyl acetate 75.26
    decalin 24.7
    glycerin 192.52
    diglyme 301.97
    acrylic acid 219.1
    isopropyl myristate 60.88
    n-butyric acid 242.22
    acetyl acetate 97.54
    di(2-ethylhexyl) phthalate 69.93
    ethyl propionate 78.63
    nitromethane 410.2
    1,2-diethoxyethane 140.42
    benzonitrile 125.41
    trioctyl phosphate 48.06
    1-bromopropane 97.29
    gamma-valerolactone 354.06
    n-decanol 70.96
    triethyl phosphate 52.14
    4-methyl-2-pentanol 68.56
    propionitrile 159.7
    vinylene carbonate 159.16
    1,1,2-trichlorotrifluoroethane 230.55
    DMS 96.29
    cumene 40.53
    2-octanol 51.65
    2-hexanone 81.7
    octyl acetate 80.61
    limonene 59.12
    1,2-dimethoxyethane 320.9
    ethyl orthosilicate 48.92
    tributyl phosphate 61.26
    diacetone alcohol 123.12
    N,N-dimethylaniline 93.74
    acrylonitrile 198.54
    aniline 104.94
    1,3-propanediol 244.79
    bromobenzene 79.6
    dibromomethane 200.56
    1,1,2,2-tetrachloroethane 219.57
    2-methyl-cyclohexyl acetate 79.13
    tetrabutyl urea 87.38
    diisobutyl methanol 43.57
    2-phenylethanol 89.54
    styrene 56.38
    dioctyl adipate 99.55
    dimethyl sulfate 103.89
    ethyl butyrate 73.4
    methyl lactate 100.66
    butyl lactate 70.69
    diethyl carbonate 64.27
    propanediol butyl ether 152.59
    triethyl orthoformate 61.73
    p-tert-butyltoluene 33.86
    methyl 4-tert-butylbenzoate 113.15
    morpholine 396.69
    tert-butylamine 179.39
    n-dodecanol 55.21
    dimethoxymethane 201.24
    ethylene carbonate 120.56
    cyrene 137.73
    2-ethoxyethyl acetate 93.78
    2-ethylhexyl acetate 54.37
    1,2,4-trichlorobenzene 108.86
    4-methylpyridine 190.98
    dibutyl ether 96.84
    2,6-dimethyl-4-heptanol 43.57
    DEF 194.56
    dimethyl isosorbide 216.26
    tetrachloroethylene 139.2
    eugenol 112.36
    triacetin 149.45
    span 80 165.78
    1,4-butanediol 103.82
    1,1-dichloroethane 154.01
    2-methyl-1-pentanol 125.55
    methyl formate 161.12
    2-methyl-1-butanol 153.92
    n-decane 18.16
    butyronitrile 165.62
    3,7-dimethyl-1-octanol 93.04
    1-chlorooctane 53.86
    1-chlorotetradecane 27.19
    n-nonane 17.54
    undecane 14.17
    tert-butylcyclohexane 23.0
    cyclooctane 14.53
    cyclopentanol 228.95
    tetrahydropyran 277.8
    tert-amyl methyl ether 108.33
    2,5,8-trioxanonane 280.18
    1-hexene 82.39
    2-isopropoxyethanol 122.89
    2,2,2-trifluoroethanol 116.79
    methyl butyrate 107.92

    Scent© AI

1 4

IFRA standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction