3-Tetradecanone

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    629-23-2

    Molecular formula
    C14H28O

    SMILES
    CCCCCCCCCCCC(=O)CC

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fatty 72.88%
    Waxy 67.59%
    Fruity 57.73%
    Oily 52.85%
    Floral 49.89%
    Citrus 42.19%
    Dairy 42.14%
    Orange 39.83%
    Creamy 39.25%
    Fresh 38.2%

    Scent© AI

  • Properties

    XLogP3-AA
    5.6

    pKa est.
    8.26 (weak base)

    Molecular weight
    212.37 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    282°C

    Flash point est.
    110.79 ˚C

  • Synonyms

    • 3-Tetradecanone
    • 629-23-2
    • Tetradecan-3-one
    • Ethyl Undecyl Ketone
    • 8A6HE775UW
    • NSC-158516
    • DTXSID30212073
    • NSC 158516
    • 3Tetradecanone
    • EINECS 211-081-9
    • NSC158516
    • AI3-04251
    • UNII-8A6HE775UW
    • SCHEMBL2126644
    • 3-Tetradecanone;Ai3-04251
    • DTXCID30134564
    • LMFA12000178
    • MFCD00026563
    • AKOS009159188
    • FE66936
    • CS-0326797
    • NS00043199
    • T1760
    • T72737
    • Q63398254

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3681.47
    methanol 2367.45
    isopropanol 5107.09
    water 0.02
    ethyl acetate 8260.75
    n-propanol 4257.23
    acetone 9123.16
    n-butanol 4354.57
    acetonitrile 4267.73
    DMF 4229.91
    toluene 2631.18
    isobutanol 3584.02
    1,4-dioxane 7093.13
    methyl acetate 4677.12
    THF 9926.98
    2-butanone 7703.16
    n-pentanol 3011.13
    sec-butanol 4601.31
    n-hexane 3803.22
    ethylene glycol 111.16
    NMP 3366.58
    cyclohexane 4829.07
    DMSO 4134.67
    n-butyl acetate 8418.41
    n-octanol 1654.72
    chloroform 10383.55
    n-propyl acetate 7187.66
    acetic acid 1616.64
    dichloromethane 10046.17
    cyclohexanone 11312.12
    propylene glycol 374.18
    isopropyl acetate 6135.54
    DMAc 3199.21
    2-ethoxyethanol 2756.24
    isopentanol 4454.76
    n-heptane 1937.76
    ethyl formate 2835.34
    1,2-dichloroethane 7454.48
    n-hexanol 3390.01
    2-methoxyethanol 3618.16
    isobutyl acetate 3745.46
    tetrachloromethane 2416.17
    n-pentyl acetate 4874.67
    transcutol 9876.81
    n-heptanol 1596.99
    ethylbenzene 1795.56
    MIBK 4380.65
    2-propoxyethanol 3794.9
    tert-butanol 6375.75
    MTBE 9392.37
    2-butoxyethanol 2468.71
    propionic acid 2136.56
    o-xylene 1586.86
    formic acid 168.14
    diethyl ether 11125.72
    m-xylene 1627.64
    p-xylene 2367.83
    chlorobenzene 3441.01
    dimethyl carbonate 671.96
    n-octane 573.54
    formamide 361.0
    cyclopentanone 7658.56
    2-pentanone 8112.35
    anisole 2619.83
    cyclopentyl methyl ether 6823.11
    gamma-butyrolactone 5842.47
    1-methoxy-2-propanol 3598.97
    pyridine 6549.37
    3-pentanone 4705.02
    furfural 3897.69
    n-dodecane 228.07
    diethylene glycol 1072.42
    diisopropyl ether 3240.85
    tert-amyl alcohol 5101.6
    acetylacetone 5209.05
    n-hexadecane 287.54
    acetophenone 2337.26
    methyl propionate 3784.82
    isopentyl acetate 6799.92
    trichloroethylene 9743.47
    n-nonanol 1438.41
    cyclohexanol 5140.93
    benzyl alcohol 1581.54
    2-ethylhexanol 3155.32
    isooctanol 1615.03
    dipropyl ether 7550.43
    1,2-dichlorobenzene 3060.7
    ethyl lactate 1214.61
    propylene carbonate 3432.72
    n-methylformamide 1651.97
    2-pentanol 3983.57
    n-pentane 1810.45
    1-propoxy-2-propanol 4236.37
    1-methoxy-2-propyl acetate 4164.79
    2-(2-methoxypropoxy) propanol 1638.73
    mesitylene 1214.26
    ε-caprolactone 7778.57
    p-cymene 1240.42
    epichlorohydrin 6734.68
    1,1,1-trichloroethane 8347.77
    2-aminoethanol 553.6
    morpholine-4-carbaldehyde 3967.22
    sulfolane 5420.1
    2,2,4-trimethylpentane 567.75
    2-methyltetrahydrofuran 10537.16
    n-hexyl acetate 4873.16
    isooctane 502.39
    2-(2-butoxyethoxy)ethanol 2539.92
    sec-butyl acetate 4883.9
    tert-butyl acetate 5717.54
    decalin 1212.2
    glycerin 405.57
    diglyme 5345.09
    acrylic acid 1023.38
    isopropyl myristate 1548.87
    n-butyric acid 5711.21
    acetyl acetate 3019.39
    di(2-ethylhexyl) phthalate 835.44
    ethyl propionate 5300.17
    nitromethane 3443.25
    1,2-diethoxyethane 7645.48
    benzonitrile 3100.71
    trioctyl phosphate 715.11
    1-bromopropane 7705.47
    gamma-valerolactone 8156.16
    n-decanol 916.3
    triethyl phosphate 1437.03
    4-methyl-2-pentanol 2074.29
    propionitrile 4731.47
    vinylene carbonate 2568.52
    1,1,2-trichlorotrifluoroethane 3311.18
    DMS 1934.95
    cumene 1149.47
    2-octanol 1511.84
    2-hexanone 6227.87
    octyl acetate 1639.03
    limonene 2503.75
    1,2-dimethoxyethane 8123.77
    ethyl orthosilicate 1582.59
    tributyl phosphate 1068.54
    diacetone alcohol 3494.6
    N,N-dimethylaniline 1612.74
    acrylonitrile 3488.55
    aniline 2463.94
    1,3-propanediol 1389.08
    bromobenzene 4091.04
    dibromomethane 8334.6
    1,1,2,2-tetrachloroethane 8976.59
    2-methyl-cyclohexyl acetate 2744.67
    tetrabutyl urea 1345.18
    diisobutyl methanol 1880.99
    2-phenylethanol 1707.3
    styrene 2409.58
    dioctyl adipate 1860.73
    dimethyl sulfate 971.58
    ethyl butyrate 6052.42
    methyl lactate 851.18
    butyl lactate 2209.98
    diethyl carbonate 2696.94
    propanediol butyl ether 1569.65
    triethyl orthoformate 3571.49
    p-tert-butyltoluene 1138.01
    methyl 4-tert-butylbenzoate 1658.24
    morpholine 9656.41
    tert-butylamine 4863.39
    n-dodecanol 656.02
    dimethoxymethane 3086.28
    ethylene carbonate 2941.87
    cyrene 1085.55
    2-ethoxyethyl acetate 3923.08
    2-ethylhexyl acetate 5373.31
    1,2,4-trichlorobenzene 3115.98
    4-methylpyridine 6630.65
    dibutyl ether 6202.08
    2,6-dimethyl-4-heptanol 1880.99
    DEF 6836.83
    dimethyl isosorbide 2711.56
    tetrachloroethylene 5927.66
    eugenol 1348.87
    triacetin 2533.41
    span 80 1739.63
    1,4-butanediol 511.56
    1,1-dichloroethane 8902.34
    2-methyl-1-pentanol 2783.75
    methyl formate 987.04
    2-methyl-1-butanol 3753.75
    n-decane 586.93
    butyronitrile 6367.5
    3,7-dimethyl-1-octanol 2001.74
    1-chlorooctane 2024.43
    1-chlorotetradecane 575.05
    n-nonane 688.51
    undecane 337.42
    tert-butylcyclohexane 1042.67
    cyclooctane 1163.32
    cyclopentanol 4094.27
    tetrahydropyran 14533.0
    tert-amyl methyl ether 5579.54
    2,5,8-trioxanonane 2687.56
    1-hexene 7773.43
    2-isopropoxyethanol 2562.14
    2,2,2-trifluoroethanol 395.22
    methyl butyrate 7574.84

    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
Cochlospermum planchonii tubercle Cochlospermum planchonii A.Rich, fam. Bixaceae (Cochlospermaceae) 69.8%
Cochlospermum tinctorium tubercle Cochlospermum tinctorium (Hook.), fam. Bixaceae (Cochlospermaceae) 64.6%