1,1-Diethoxytridecane

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  • Identifiers

    CAS number
    72934-16-8

    Molecular formula
    C17H36O2

    SMILES
    CCCCCCCCCCCCC(OCC)OCC

  • Odor profile

    Fragrance
    Fruity 75.96%
    Citrus 68.24%
    Fatty 58.0%
    Waxy 57.5%
    Fresh 57.04%
    Oily 51.62%
    Floral 48.33%
    Green 43.94%
    Orange 42.58%
    Clean 35.51%

     

    Flavor
    Waxy 61.79%
    Fruity 45.35%
    Floral 45.04%
    Oily 40.23%
    Green 40.16%
    Fatty 38.73%
    Rose 37.31%
    Soapy 37.09%
    Clean 36.53%
    Mushroom 35.19%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    7.0

    pKa est.
    6.75 (neutral)

    Molecular weight
    272.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    304°C

    Flash point

    • 126.78 ˚C est.

  • Synonyms

    • 1,1-Diethoxytridecane
    • 72934-16-8
    • Tridecane,1,1-diethoxy-
    • EINECS 277-103-4
    • DTXSID70993713
    • tridecanal diethyl acetal
    • XWXXXLODHHHRGE-UHFFFAOYSA-N
    • DTXCID501420755
    • MFCD11554355
    • NS00061712
    • 277-103-4

  • Applications

    1,1-Diethoxytridecane (CAS 72934-16-8) can act as a non-polar solvent and processing aid in industrial manufacturing; as an intermediate in fragrance chemistry and polymer synthesis; and as a potential plasticizer for certain polymers or a formulation component in cosmetics/personal care. Its use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2283.73
    methanol 1268.01
    isopropanol 3374.34
    water 0.09
    ethyl acetate 10075.55
    n-propanol 3458.54
    acetone 7760.8
    n-butanol 4364.12
    acetonitrile 3566.09
    DMF 4069.58
    toluene 4513.78
    isobutanol 3718.39
    1,4-dioxane 9257.19
    methyl acetate 5619.12
    THF 13314.66
    2-butanone 7684.89
    n-pentanol 3001.83
    sec-butanol 4595.13
    n-hexane 6138.73
    ethylene glycol 99.54
    NMP 6421.43
    cyclohexane 16637.07
    DMSO 5050.0
    n-butyl acetate 10913.79
    n-octanol 2695.19
    chloroform 17901.25
    n-propyl acetate 9621.54
    acetic acid 2020.68
    dichloromethane 18022.85
    cyclohexanone 17902.37
    propylene glycol 292.53
    isopropyl acetate 8353.61
    DMAc 4749.56
    2-ethoxyethanol 2712.95
    isopentanol 4888.97
    n-heptane 6165.88
    ethyl formate 3713.33
    1,2-dichloroethane 12731.88
    n-hexanol 3622.63
    2-methoxyethanol 2975.08
    isobutyl acetate 5834.47
    tetrachloromethane 5848.57
    n-pentyl acetate 9100.37
    transcutol 8801.79
    n-heptanol 2346.62
    ethylbenzene 3056.57
    MIBK 6257.57
    2-propoxyethanol 3537.51
    tert-butanol 5417.36
    MTBE 10426.89
    2-butoxyethanol 3091.32
    propionic acid 2639.93
    o-xylene 3188.77
    formic acid 180.31
    diethyl ether 12230.78
    m-xylene 2914.74
    p-xylene 4385.08
    chlorobenzene 5849.39
    dimethyl carbonate 1232.02
    n-octane 1788.06
    formamide 403.77
    cyclopentanone 11822.35
    2-pentanone 8926.87
    anisole 3679.42
    cyclopentyl methyl ether 12259.42
    gamma-butyrolactone 9378.36
    1-methoxy-2-propanol 3350.04
    pyridine 8355.58
    3-pentanone 7453.6
    furfural 5289.11
    n-dodecane 699.73
    diethylene glycol 929.95
    diisopropyl ether 5476.15
    tert-amyl alcohol 5905.55
    acetylacetone 6742.95
    n-hexadecane 866.53
    acetophenone 3861.37
    methyl propionate 5422.32
    isopentyl acetate 9175.21
    trichloroethylene 15976.73
    n-nonanol 2490.99
    cyclohexanol 8918.81
    benzyl alcohol 2030.26
    2-ethylhexanol 4528.93
    isooctanol 2484.81
    dipropyl ether 11853.49
    1,2-dichlorobenzene 5488.43
    ethyl lactate 1805.57
    propylene carbonate 5794.24
    n-methylformamide 1682.05
    2-pentanol 4620.07
    n-pentane 4140.19
    1-propoxy-2-propanol 4581.36
    1-methoxy-2-propyl acetate 5394.29
    2-(2-methoxypropoxy) propanol 1960.51
    mesitylene 2396.84
    ε-caprolactone 13044.91
    p-cymene 2707.67
    epichlorohydrin 10197.18
    1,1,1-trichloroethane 14922.5
    2-aminoethanol 453.13
    morpholine-4-carbaldehyde 5343.81
    sulfolane 9804.16
    2,2,4-trimethylpentane 1720.45
    2-methyltetrahydrofuran 15505.49
    n-hexyl acetate 8485.37
    isooctane 1206.99
    2-(2-butoxyethoxy)ethanol 2899.18
    sec-butyl acetate 7272.09
    tert-butyl acetate 8612.25
    decalin 3407.71
    glycerin 332.75
    diglyme 7232.97
    acrylic acid 1338.77
    isopropyl myristate 3068.93
    n-butyric acid 6903.15
    acetyl acetate 4919.5
    di(2-ethylhexyl) phthalate 1399.0
    ethyl propionate 7993.6
    nitromethane 4352.94
    1,2-diethoxyethane 9496.26
    benzonitrile 3925.89
    trioctyl phosphate 1433.1
    1-bromopropane 12731.55
    gamma-valerolactone 11003.81
    n-decanol 1621.96
    triethyl phosphate 2983.64
    4-methyl-2-pentanol 2790.53
    propionitrile 4711.47
    vinylene carbonate 4275.81
    1,1,2-trichlorotrifluoroethane 4992.38
    DMS 3271.14
    cumene 2166.49
    2-octanol 2537.63
    2-hexanone 7606.27
    octyl acetate 3290.93
    limonene 5770.53
    1,2-dimethoxyethane 8732.94
    ethyl orthosilicate 3296.07
    tributyl phosphate 2016.88
    diacetone alcohol 4610.77
    N,N-dimethylaniline 2699.06
    acrylonitrile 3538.45
    aniline 3358.37
    1,3-propanediol 1139.06
    bromobenzene 7747.72
    dibromomethane 15256.62
    1,1,2,2-tetrachloroethane 15397.09
    2-methyl-cyclohexyl acetate 5168.82
    tetrabutyl urea 2632.11
    diisobutyl methanol 3224.42
    2-phenylethanol 2057.16
    styrene 3697.85
    dioctyl adipate 3476.92
    dimethyl sulfate 1865.83
    ethyl butyrate 9944.02
    methyl lactate 1259.6
    butyl lactate 3646.94
    diethyl carbonate 4839.68
    propanediol butyl ether 1932.95
    triethyl orthoformate 6472.87
    p-tert-butyltoluene 2477.24
    methyl 4-tert-butylbenzoate 3023.41
    morpholine 10996.48
    tert-butylamine 4993.76
    n-dodecanol 1233.32
    dimethoxymethane 3742.6
    ethylene carbonate 5152.71
    cyrene 1629.86
    2-ethoxyethyl acetate 6137.77
    2-ethylhexyl acetate 8020.72
    1,2,4-trichlorobenzene 5454.76
    4-methylpyridine 8683.87
    dibutyl ether 10408.43
    2,6-dimethyl-4-heptanol 3224.42
    DEF 9402.85
    dimethyl isosorbide 3751.04
    tetrachloroethylene 10856.06
    eugenol 1970.88
    triacetin 4720.23
    span 80 2514.28
    1,4-butanediol 516.97
    1,1-dichloroethane 13345.1
    2-methyl-1-pentanol 3320.94
    methyl formate 1215.79
    2-methyl-1-butanol 4615.99
    n-decane 1706.89
    butyronitrile 6222.99
    3,7-dimethyl-1-octanol 3190.7
    1-chlorooctane 4503.87
    1-chlorotetradecane 1450.43
    n-nonane 2017.8
    undecane 1001.95
    tert-butylcyclohexane 2632.37
    cyclooctane 4172.66
    cyclopentanol 6705.06
    tetrahydropyran 20554.48
    tert-amyl methyl ether 7791.82
    2,5,8-trioxanonane 3331.26
    1-hexene 8432.3
    2-isopropoxyethanol 2730.3
    2,2,2-trifluoroethanol 708.25
    methyl butyrate 10494.95

    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