1,3-Dioxolane-4-methanol, 2-propyl-

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  • Identifiers

    CAS number
    4379-23-1

    Molecular formula
    C7H14O3

    SMILES
    CCCC1OCC(O1)CO

  • Odor profile

    Fragrance
    Fruity 87.66%
    Green 63.99%
    Ethereal 56.81%
    Fermented 48.78%
    Alcoholic 37.71%
    Sweet 36.9%
    Buttery 33.22%
    Fatty 32.86%
    Winey 32.65%
    Oily 30.64%

     

    Flavor
    Sweet 50.24%
    Caramel 42.53%
    Vegetable 41.33%
    Oily 35.68%
    Fatty 34.08%
    Roasted 26.79%
    Cauliflower 26.4%
    Burnt 25.94%
    Green 25.65%
    Musty 25.59%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    0.5

    pKa est.
    7.27 (neutral)

    Molecular weight
    146.18 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    234°C

    Flash point

    • 96.2 ˚C est.

  • Synonyms

    • 1,3-Dioxolane-4-methanol, 2-propyl-
    • 4379-23-1
    • (2-propyl-1,3-dioxolan-4-yl)methanol
    • SCHEMBL4876623
    • DTXSID90863388
    • MCDLJNJNGRFOOF-UHFFFAOYSA-N
    • DB-322658

  • Applications

    Chemical name: 1,3-Dioxolane-4-methanol, 2-propyl-; CAS number: 4379-23-1 may serve as an organic synthesis intermediate in fragrance and flavor chemistry, cosmetics and personal care, and pharmaceutical synthesis; it can also act as a protecting group in organic synthesis, a solvent or processing aid in coatings, inks, and cleaning formulations; and as a building block for specialty polymers and plastics.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2228.08
    methanol 3943.93
    isopropanol 1292.12
    water 59.46
    ethyl acetate 439.1
    n-propanol 1278.01
    acetone 983.94
    n-butanol 954.11
    acetonitrile 965.63
    DMF 1269.01
    toluene 92.62
    isobutanol 796.9
    1,4-dioxane 861.83
    methyl acetate 459.01
    THF 1118.22
    2-butanone 476.99
    n-pentanol 535.86
    sec-butanol 775.14
    n-hexane 21.65
    ethylene glycol 940.78
    NMP 811.06
    cyclohexane 52.0
    DMSO 2549.84
    n-butyl acetate 320.15
    n-octanol 191.09
    chloroform 1741.62
    n-propyl acetate 302.23
    acetic acid 2489.78
    dichloromethane 1779.17
    cyclohexanone 701.3
    propylene glycol 885.95
    isopropyl acetate 234.59
    DMAc 657.42
    2-ethoxyethanol 859.9
    isopentanol 604.79
    n-heptane 23.53
    ethyl formate 596.7
    1,2-dichloroethane 753.42
    n-hexanol 395.38
    2-methoxyethanol 1581.75
    isobutyl acetate 185.72
    tetrachloromethane 229.14
    n-pentyl acetate 186.98
    transcutol 1371.38
    n-heptanol 172.75
    ethylbenzene 60.42
    MIBK 213.26
    2-propoxyethanol 668.39
    tert-butanol 1059.15
    MTBE 357.19
    2-butoxyethanol 340.56
    propionic acid 1064.14
    o-xylene 85.65
    formic acid 1446.43
    diethyl ether 322.25
    m-xylene 83.81
    p-xylene 100.71
    chlorobenzene 294.83
    dimethyl carbonate 160.2
    n-octane 10.28
    formamide 1276.18
    cyclopentanone 863.58
    2-pentanone 362.58
    anisole 212.52
    cyclopentyl methyl ether 348.82
    gamma-butyrolactone 1160.77
    1-methoxy-2-propanol 858.45
    pyridine 641.01
    3-pentanone 201.28
    furfural 1065.2
    n-dodecane 11.71
    diethylene glycol 726.66
    diisopropyl ether 75.67
    tert-amyl alcohol 629.56
    acetylacetone 423.06
    n-hexadecane 13.2
    acetophenone 246.63
    methyl propionate 318.34
    isopentyl acetate 262.79
    trichloroethylene 1398.93
    n-nonanol 150.1
    cyclohexanol 544.78
    benzyl alcohol 311.39
    2-ethylhexanol 193.08
    isooctanol 139.91
    dipropyl ether 158.72
    1,2-dichlorobenzene 283.23
    ethyl lactate 215.75
    propylene carbonate 635.74
    n-methylformamide 1124.15
    2-pentanol 438.24
    n-pentane 29.43
    1-propoxy-2-propanol 420.34
    1-methoxy-2-propyl acetate 259.44
    2-(2-methoxypropoxy) propanol 290.82
    mesitylene 64.52
    ε-caprolactone 620.93
    p-cymene 70.57
    epichlorohydrin 964.04
    1,1,1-trichloroethane 559.14
    2-aminoethanol 1325.25
    morpholine-4-carbaldehyde 801.15
    sulfolane 1321.24
    2,2,4-trimethylpentane 25.26
    2-methyltetrahydrofuran 652.32
    n-hexyl acetate 270.39
    isooctane 18.64
    2-(2-butoxyethoxy)ethanol 414.74
    sec-butyl acetate 164.8
    tert-butyl acetate 229.43
    decalin 26.83
    glycerin 1054.13
    diglyme 734.0
    acrylic acid 1028.4
    isopropyl myristate 98.56
    n-butyric acid 1205.88
    acetyl acetate 341.02
    di(2-ethylhexyl) phthalate 129.97
    ethyl propionate 208.53
    nitromethane 1993.34
    1,2-diethoxyethane 279.41
    benzonitrile 422.31
    trioctyl phosphate 99.61
    1-bromopropane 344.32
    gamma-valerolactone 929.47
    n-decanol 106.77
    triethyl phosphate 120.51
    4-methyl-2-pentanol 204.5
    propionitrile 622.72
    vinylene carbonate 626.53
    1,1,2-trichlorotrifluoroethane 1023.07
    DMS 199.9
    cumene 58.82
    2-octanol 116.52
    2-hexanone 260.58
    octyl acetate 134.93
    limonene 110.53
    1,2-dimethoxyethane 887.74
    ethyl orthosilicate 110.02
    tributyl phosphate 122.99
    diacetone alcohol 348.58
    N,N-dimethylaniline 148.0
    acrylonitrile 844.79
    aniline 306.25
    1,3-propanediol 1244.11
    bromobenzene 263.27
    dibromomethane 957.88
    1,1,2,2-tetrachloroethane 1031.72
    2-methyl-cyclohexyl acetate 181.57
    tetrabutyl urea 143.5
    diisobutyl methanol 108.86
    2-phenylethanol 248.67
    styrene 90.39
    dioctyl adipate 173.45
    dimethyl sulfate 320.69
    ethyl butyrate 218.81
    methyl lactate 298.77
    butyl lactate 210.28
    diethyl carbonate 162.87
    propanediol butyl ether 417.91
    triethyl orthoformate 155.18
    p-tert-butyltoluene 66.65
    methyl 4-tert-butylbenzoate 229.61
    morpholine 1040.54
    tert-butylamine 556.29
    n-dodecanol 81.37
    dimethoxymethane 499.12
    ethylene carbonate 505.81
    cyrene 304.13
    2-ethoxyethyl acetate 228.02
    2-ethylhexyl acetate 178.13
    1,2,4-trichlorobenzene 359.17
    4-methylpyridine 477.43
    dibutyl ether 139.93
    2,6-dimethyl-4-heptanol 108.86
    DEF 446.89
    dimethyl isosorbide 384.38
    tetrachloroethylene 727.16
    eugenol 249.66
    triacetin 292.41
    span 80 280.93
    1,4-butanediol 555.46
    1,1-dichloroethane 732.92
    2-methyl-1-pentanol 364.62
    methyl formate 822.84
    2-methyl-1-butanol 563.1
    n-decane 18.66
    butyronitrile 680.4
    3,7-dimethyl-1-octanol 177.77
    1-chlorooctane 90.38
    1-chlorotetradecane 35.87
    n-nonane 17.45
    undecane 14.07
    tert-butylcyclohexane 25.04
    cyclooctane 17.04
    cyclopentanol 731.1
    tetrahydropyran 637.42
    tert-amyl methyl ether 213.7
    2,5,8-trioxanonane 467.3
    1-hexene 97.62
    2-isopropoxyethanol 453.82
    2,2,2-trifluoroethanol 719.52
    methyl butyrate 357.21

    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