8-Methylnonanoic acid

  • Identifiers

    CAS number
    5963-14-4

    Molecular formula
    C10H20O2

    SMILES
    CC(C)CCCCCCC(=O)O

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fatty 78.53%
    Waxy 59.15%
    Cheesy 57.46%
    Sour 45.57%
    Dairy 45.27%
    Milky 40.55%
    Oily 39.74%
    Creamy 38.04%
    Sweaty 37.72%
    Animal 29.1%

    Scent© AI

  • Properties

    XLogP3-AA
    3.8

    pKa est.
    8.22 (weak base)

    Molecular weight
    172.26 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    260°C

    Flash point est.
    123.25 ˚C

  • Synonyms

    • 8-Methylnonanoic acid
    • 5963-14-4
    • Isodecanoic acid
    • isocapric acid
    • 26403-17-8
    • 8-methyl-nonanoic acid
    • Nonanoic acid, 8-methyl-
    • MFCD00044086
    • LW5786QCKT
    • YL95S7AP4Z
    • UNII-LW5786QCKT
    • Versatic acid
    • EINECS 247-673-9
    • LMFA01020247
    • CEKANOIC ACID
    • 8-methyl Nonanoic Acid
    • AI3-05976
    • CEKANOIC C10 ACID
    • UNII-YL95S7AP4Z
    • SCHEMBL633844
    • DTXSID1067207
    • CHEBI:176811
    • AKOS016845711
    • AT35562
    • HY-W127524
    • PD020798
    • CS-0185751
    • NS00021087
    • EN300-7366555
    • Q27283214
  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2124.14
    methanol 2179.72
    isopropanol 1985.02
    water 0.2
    ethyl acetate 641.94
    n-propanol 1463.0
    acetone 1403.27
    n-butanol 1355.47
    acetonitrile 329.93
    DMF 1079.06
    toluene 130.78
    isobutanol 1124.26
    1,4-dioxane 873.88
    methyl acetate 402.88
    THF 2341.36
    2-butanone 844.41
    n-pentanol 1076.8
    sec-butanol 1135.98
    n-hexane 337.68
    ethylene glycol 218.45
    NMP 703.19
    cyclohexane 107.7
    DMSO 1579.57
    n-butyl acetate 784.35
    n-octanol 341.22
    chloroform 536.71
    n-propyl acetate 593.42
    acetic acid 599.38
    dichloromethane 393.26
    cyclohexanone 1069.39
    propylene glycol 551.23
    isopropyl acetate 609.43
    DMAc 573.87
    2-ethoxyethanol 908.25
    isopentanol 1222.87
    n-heptane 78.68
    ethyl formate 296.12
    1,2-dichloroethane 429.07
    n-hexanol 1184.52
    2-methoxyethanol 1446.91
    isobutyl acetate 450.46
    tetrachloromethane 106.98
    n-pentyl acetate 360.09
    transcutol 2251.74
    n-heptanol 406.8
    ethylbenzene 121.62
    MIBK 668.73
    2-propoxyethanol 1367.65
    tert-butanol 2236.45
    MTBE 1246.86
    2-butoxyethanol 641.61
    propionic acid 542.9
    o-xylene 116.15
    formic acid 162.32
    diethyl ether 790.2
    m-xylene 170.64
    p-xylene 159.67
    chlorobenzene 163.48
    dimethyl carbonate 89.81
    n-octane 27.81
    formamide 201.29
    cyclopentanone 1279.57
    2-pentanone 955.46
    anisole 281.59
    cyclopentyl methyl ether 1052.04
    gamma-butyrolactone 968.79
    1-methoxy-2-propanol 1431.18
    pyridine 388.0
    3-pentanone 423.26
    furfural 557.65
    n-dodecane 15.85
    diethylene glycol 729.64
    diisopropyl ether 321.85
    tert-amyl alcohol 1328.4
    acetylacetone 675.5
    n-hexadecane 18.29
    acetophenone 254.79
    methyl propionate 401.21
    isopentyl acetate 751.29
    trichloroethylene 587.57
    n-nonanol 285.47
    cyclohexanol 840.44
    benzyl alcohol 287.22
    2-ethylhexanol 558.09
    isooctanol 346.43
    dipropyl ether 572.86
    1,2-dichlorobenzene 174.31
    ethyl lactate 222.67
    propylene carbonate 469.05
    n-methylformamide 502.48
    2-pentanol 987.64
    n-pentane 119.22
    1-propoxy-2-propanol 1079.41
    1-methoxy-2-propyl acetate 673.97
    2-(2-methoxypropoxy) propanol 453.19
    mesitylene 128.49
    ε-caprolactone 765.63
    p-cymene 95.61
    epichlorohydrin 989.66
    1,1,1-trichloroethane 375.12
    2-aminoethanol 723.18
    morpholine-4-carbaldehyde 762.43
    sulfolane 1188.29
    2,2,4-trimethylpentane 63.26
    2-methyltetrahydrofuran 1535.8
    n-hexyl acetate 527.36
    isooctane 67.58
    2-(2-butoxyethoxy)ethanol 766.01
    sec-butyl acetate 450.91
    tert-butyl acetate 748.44
    decalin 70.03
    glycerin 496.4
    diglyme 1066.03
    acrylic acid 291.89
    isopropyl myristate 177.19
    n-butyric acid 1075.75
    acetyl acetate 238.0
    di(2-ethylhexyl) phthalate 164.8
    ethyl propionate 392.81
    nitromethane 559.83
    1,2-diethoxyethane 703.29
    benzonitrile 261.32
    trioctyl phosphate 140.07
    1-bromopropane 360.48
    gamma-valerolactone 1207.66
    n-decanol 206.89
    triethyl phosphate 140.4
    4-methyl-2-pentanol 587.34
    propionitrile 390.07
    vinylene carbonate 298.74
    1,1,2-trichlorotrifluoroethane 622.9
    DMS 208.33
    cumene 113.43
    2-octanol 271.95
    2-hexanone 809.34
    octyl acetate 222.77
    limonene 187.62
    1,2-dimethoxyethane 1181.93
    ethyl orthosilicate 161.33
    tributyl phosphate 167.96
    diacetone alcohol 965.56
    N,N-dimethylaniline 203.92
    acrylonitrile 325.52
    aniline 281.83
    1,3-propanediol 979.61
    bromobenzene 153.03
    dibromomethane 340.1
    1,1,2,2-tetrachloroethane 634.2
    2-methyl-cyclohexyl acetate 344.41
    tetrabutyl urea 204.16
    diisobutyl methanol 289.51
    2-phenylethanol 364.3
    styrene 132.53
    dioctyl adipate 239.3
    dimethyl sulfate 167.73
    ethyl butyrate 440.43
    methyl lactate 255.11
    butyl lactate 328.14
    diethyl carbonate 192.87
    propanediol butyl ether 630.13
    triethyl orthoformate 284.8
    p-tert-butyltoluene 107.61
    methyl 4-tert-butylbenzoate 283.57
    morpholine 1425.12
    tert-butylamine 1277.35
    n-dodecanol 145.63
    dimethoxymethane 634.42
    ethylene carbonate 283.87
    cyrene 352.06
    2-ethoxyethyl acetate 396.32
    2-ethylhexyl acetate 515.14
    1,2,4-trichlorobenzene 205.34
    4-methylpyridine 461.58
    dibutyl ether 394.87
    2,6-dimethyl-4-heptanol 289.51
    DEF 705.62
    dimethyl isosorbide 657.38
    tetrachloroethylene 407.54
    eugenol 297.36
    triacetin 331.43
    span 80 478.25
    1,4-butanediol 424.7
    1,1-dichloroethane 485.94
    2-methyl-1-pentanol 851.27
    methyl formate 229.94
    2-methyl-1-butanol 947.25
    n-decane 32.85
    butyronitrile 612.03
    3,7-dimethyl-1-octanol 393.69
    1-chlorooctane 160.68
    1-chlorotetradecane 49.3
    n-nonane 34.91
    undecane 22.23
    tert-butylcyclohexane 92.27
    cyclooctane 37.75
    cyclopentanol 1033.03
    tetrahydropyran 1327.84
    tert-amyl methyl ether 721.75
    2,5,8-trioxanonane 656.66
    1-hexene 818.6
    2-isopropoxyethanol 771.61
    2,2,2-trifluoroethanol 128.55
    methyl butyrate 582.3

    Scent© AI

1 of 4
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