Isopropyl dodecanoate

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  • Identifiers

    CAS number
    10233-13-3

    Molecular formula
    C15H30O2

    SMILES
    CCCCCCCCCCCC(=O)OC(C)C

  • Odor profile

    Fatty 75.16%
    Oily 73.68%
    Fruity 70.04%
    Waxy 66.09%
    Winey 52.68%
    Cognac 47.89%
    Creamy 44.01%
    Brandy 37.4%
    Sweet 36.64%
    Floral 36.64%

    Scent© AI

  • Properties

    XLogP3-AA
    6.1

    pKa est.
    7.45 (neutral)

    Molecular weight
    242.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    286°C

    Flash point est.
    119.33 ˚C

  • Synonyms

    • Isopropyl dodecanoate
    • ISOPROPYL LAURATE
    • 10233-13-3
    • propan-2-yl dodecanoate
    • Dodecanoic acid, 1-methylethyl ester
    • 1-Methylethyl dodecanoate
    • UNII-U0JQ94LABM
    • U0JQ94LABM
    • iso-Propyl dodecanoate
    • EINECS 233-560-1
    • DUB LAIP
    • LEXOL IPL
    • MFCD00451146
    • AEC ISOPROPYL LAURATE
    • WE(2:0(1Me)/12:0)
    • DTXSID3041904
    • CHEBI:89676
    • Dodecanoic acid methylethyl ester
    • EC 233-560-1
    • Isopropyl_laurate
    • SCHEMBL44513
    • Isopropyl laurate, AldrichCPR
    • Isopropyl lauric acid
    • Isopropyl_lauric acid
    • 1-Methylethyl dodecanoic acid
    • Dodecanoate methyl ethyl ester
    • dodecanoic acid isopropyl ester
    • DTXCID1021904
    • ISOPROPYL LAURATE [INCI]
    • Dodecanoic acid methyl ethyl ester
    • LMFA07010674
    • AKOS014763161
    • CS-W002613
    • DS-2780
    • SY003934
    • DB-058798
    • NS00003346
    • Q5971737
    • 233-560-1
    • 56S

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4352.2
    methanol 3591.91
    isopropanol 5440.18
    water 0.06
    ethyl acetate 6443.8
    n-propanol 4590.93
    acetone 9346.81
    n-butanol 4393.12
    acetonitrile 3963.36
    DMF 5553.08
    toluene 2544.2
    isobutanol 4233.99
    1,4-dioxane 5866.59
    methyl acetate 4197.4
    THF 10445.57
    2-butanone 6826.31
    n-pentanol 3005.53
    sec-butanol 5002.96
    n-hexane 3068.36
    ethylene glycol 170.98
    NMP 5358.13
    cyclohexane 4174.28
    DMSO 5492.94
    n-butyl acetate 5738.45
    n-octanol 1533.66
    chloroform 10015.01
    n-propyl acetate 5214.26
    acetic acid 2286.72
    dichloromethane 9480.58
    cyclohexanone 11901.22
    propylene glycol 549.41
    isopropyl acetate 4986.06
    DMAc 4456.84
    2-ethoxyethanol 2556.65
    isopentanol 4402.84
    n-heptane 1064.58
    ethyl formate 2756.78
    1,2-dichloroethane 7108.94
    n-hexanol 2901.17
    2-methoxyethanol 3751.29
    isobutyl acetate 3150.79
    tetrachloromethane 2165.79
    n-pentyl acetate 3790.1
    transcutol 7274.7
    n-heptanol 1299.81
    ethylbenzene 1542.9
    MIBK 4142.4
    2-propoxyethanol 3181.96
    tert-butanol 6400.86
    MTBE 8225.29
    2-butoxyethanol 2046.03
    propionic acid 2588.59
    o-xylene 1542.41
    formic acid 295.85
    diethyl ether 8010.94
    m-xylene 1595.94
    p-xylene 2137.8
    chlorobenzene 3350.77
    dimethyl carbonate 845.73
    n-octane 370.39
    formamide 580.31
    cyclopentanone 8698.9
    2-pentanone 6961.57
    anisole 2155.89
    cyclopentyl methyl ether 7238.74
    gamma-butyrolactone 6966.27
    1-methoxy-2-propanol 3624.07
    pyridine 5767.81
    3-pentanone 4289.98
    furfural 4064.79
    n-dodecane 186.78
    diethylene glycol 1123.71
    diisopropyl ether 2627.25
    tert-amyl alcohol 5434.56
    acetylacetone 5014.44
    n-hexadecane 230.81
    acetophenone 2078.27
    methyl propionate 3675.29
    isopentyl acetate 4940.65
    trichloroethylene 9605.86
    n-nonanol 1291.67
    cyclohexanol 5847.22
    benzyl alcohol 1525.61
    2-ethylhexanol 2318.1
    isooctanol 1252.59
    dipropyl ether 4182.29
    1,2-dichlorobenzene 2903.76
    ethyl lactate 1107.77
    propylene carbonate 3830.73
    n-methylformamide 2282.46
    2-pentanol 3875.64
    n-pentane 1623.96
    1-propoxy-2-propanol 3318.26
    1-methoxy-2-propyl acetate 3363.69
    2-(2-methoxypropoxy) propanol 1535.11
    mesitylene 1205.49
    ε-caprolactone 7753.12
    p-cymene 938.19
    epichlorohydrin 7264.91
    1,1,1-trichloroethane 7843.76
    2-aminoethanol 800.71
    morpholine-4-carbaldehyde 4356.7
    sulfolane 7354.72
    2,2,4-trimethylpentane 567.79
    2-methyltetrahydrofuran 10477.96
    n-hexyl acetate 4433.21
    isooctane 422.53
    2-(2-butoxyethoxy)ethanol 2239.05
    sec-butyl acetate 3690.71
    tert-butyl acetate 5136.4
    decalin 1105.19
    glycerin 528.48
    diglyme 4506.99
    acrylic acid 1376.6
    isopropyl myristate 1396.82
    n-butyric acid 5607.16
    acetyl acetate 2858.3
    di(2-ethylhexyl) phthalate 881.94
    ethyl propionate 3967.95
    nitromethane 4444.63
    1,2-diethoxyethane 4436.4
    benzonitrile 2612.24
    trioctyl phosphate 747.16
    1-bromopropane 6684.4
    gamma-valerolactone 8667.76
    n-decanol 834.44
    triethyl phosphate 1112.12
    4-methyl-2-pentanol 1980.84
    propionitrile 3884.29
    vinylene carbonate 2871.6
    1,1,2-trichlorotrifluoroethane 3666.11
    DMS 1975.31
    cumene 1039.54
    2-octanol 1289.24
    2-hexanone 5151.21
    octyl acetate 1647.26
    limonene 2085.02
    1,2-dimethoxyethane 6317.43
    ethyl orthosilicate 1193.88
    tributyl phosphate 1037.71
    diacetone alcohol 3569.8
    N,N-dimethylaniline 1500.85
    acrylonitrile 3209.09
    aniline 2446.07
    1,3-propanediol 1611.74
    bromobenzene 3999.18
    dibromomethane 7628.52
    1,1,2,2-tetrachloroethane 9071.19
    2-methyl-cyclohexyl acetate 2392.21
    tetrabutyl urea 1371.23
    diisobutyl methanol 1321.75
    2-phenylethanol 1503.04
    styrene 1933.89
    dioctyl adipate 1809.84
    dimethyl sulfate 1352.44
    ethyl butyrate 3793.6
    methyl lactate 1031.77
    butyl lactate 1949.35
    diethyl carbonate 1782.36
    propanediol butyl ether 1640.4
    triethyl orthoformate 2269.85
    p-tert-butyltoluene 894.36
    methyl 4-tert-butylbenzoate 1701.17
    morpholine 8693.49
    tert-butylamine 4603.74
    n-dodecanol 603.98
    dimethoxymethane 3308.88
    ethylene carbonate 3119.36
    cyrene 1263.69
    2-ethoxyethyl acetate 3066.19
    2-ethylhexyl acetate 3847.41
    1,2,4-trichlorobenzene 3109.43
    4-methylpyridine 6017.77
    dibutyl ether 4133.87
    2,6-dimethyl-4-heptanol 1321.75
    DEF 6353.13
    dimethyl isosorbide 2700.39
    tetrachloroethylene 5852.27
    eugenol 1307.83
    triacetin 2564.85
    span 80 1796.15
    1,4-butanediol 651.66
    1,1-dichloroethane 8581.18
    2-methyl-1-pentanol 2763.19
    methyl formate 1332.39
    2-methyl-1-butanol 3948.19
    n-decane 439.32
    butyronitrile 5236.84
    3,7-dimethyl-1-octanol 1667.46
    1-chlorooctane 1728.11
    1-chlorotetradecane 528.24
    n-nonane 493.5
    undecane 264.2
    tert-butylcyclohexane 885.22
    cyclooctane 960.51
    cyclopentanol 5479.91
    tetrahydropyran 12638.81
    tert-amyl methyl ether 5195.42
    2,5,8-trioxanonane 2403.26
    1-hexene 6189.82
    2-isopropoxyethanol 2286.76
    2,2,2-trifluoroethanol 612.45
    methyl butyrate 5865.13

    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

Botanical

Name CAS Botanical Proportion
Fumana thymifolia Fumana thymifolia (L.) Spach ex Webb, fam. Cistaceae 2.9%