2-Methyltridecane

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    6418-41-30

    Molecular formula
    C14H30

    SMILES
    CCCCCCCCCCCC(C)C

  • Odor profile

    Waxy 70.0%
    Oily 31.32%
    Sweet 30.99%
    Gassy 27.84%
    Fatty 26.22%
    Fishy 20.76%
    Fresh 17.41%
    Odorless 16.64%
    Meaty 16.57%
    Burnt 16.5%

    Scent© AI

  • Properties

    XLogP3-AA
    7.5

    pKa est.
    8.83 (weak base)

    Molecular weight
    198.39 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    245°C

    Flash point est.
    102.34 ˚C

  • Synonyms

    • 2-METHYLTRIDECANE
    • 1560-96-9
    • Tridecane, 2-methyl-
    • 2-Methyl-n-tridecane
    • UNII-6UNR6OUH0J
    • 6UNR6OUH0J
    • CHEBI:84277
    • DTXSID30166027
    • 2-methyl-tridecane
    • Tridecane, 2methyl
    • 2-Methyltridecane-d6
    • DTXCID3088518
    • BAA56096
    • AKOS006283309
    • NS00096305
    • Q27157639

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 815.86
    methanol 233.2
    isopropanol 1370.06
    water 0.0
    ethyl acetate 4547.25
    n-propanol 1252.3
    acetone 2910.2
    n-butanol 2031.94
    acetonitrile 705.61
    DMF 1078.33
    toluene 3537.7
    isobutanol 1398.31
    1,4-dioxane 5341.57
    methyl acetate 1876.52
    THF 12365.5
    2-butanone 3700.88
    n-pentanol 1571.6
    sec-butanol 2057.8
    n-hexane 9473.38
    ethylene glycol 19.72
    NMP 1682.35
    cyclohexane 14282.3
    DMSO 1495.05
    n-butyl acetate 13063.51
    n-octanol 1683.47
    chloroform 5306.67
    n-propyl acetate 4220.24
    acetic acid 321.27
    dichloromethane 5131.94
    cyclohexanone 7499.62
    propylene glycol 90.8
    isopropyl acetate 4624.09
    DMAc 1370.02
    2-ethoxyethanol 1021.3
    isopentanol 2801.85
    n-heptane 15498.81
    ethyl formate 948.1
    1,2-dichloroethane 4763.33
    n-hexanol 4220.34
    2-methoxyethanol 1016.43
    isobutyl acetate 3546.72
    tetrachloromethane 1748.27
    n-pentyl acetate 4202.02
    transcutol 6435.63
    n-heptanol 1738.53
    ethylbenzene 2208.77
    MIBK 4360.35
    2-propoxyethanol 2920.8
    tert-butanol 3274.5
    MTBE 10040.6
    2-butoxyethanol 1805.37
    propionic acid 549.2
    o-xylene 2080.27
    formic acid 13.61
    diethyl ether 9776.02
    m-xylene 2262.98
    p-xylene 2635.6
    chlorobenzene 2358.42
    dimethyl carbonate 363.7
    n-octane 3023.53
    formamide 32.33
    cyclopentanone 5274.44
    2-pentanone 5174.87
    anisole 2277.02
    cyclopentyl methyl ether 9527.93
    gamma-butyrolactone 2995.13
    1-methoxy-2-propanol 1424.76
    pyridine 3694.55
    3-pentanone 3766.64
    furfural 1558.19
    n-dodecane 1012.1
    diethylene glycol 497.48
    diisopropyl ether 6101.89
    tert-amyl alcohol 3421.02
    acetylacetone 3192.21
    n-hexadecane 1254.63
    acetophenone 1567.48
    methyl propionate 2009.02
    isopentyl acetate 11265.32
    trichloroethylene 4924.32
    n-nonanol 1768.72
    cyclohexanol 3651.51
    benzyl alcohol 775.18
    2-ethylhexanol 6646.09
    isooctanol 2044.73
    dipropyl ether 22859.54
    1,2-dichlorobenzene 2053.67
    ethyl lactate 611.78
    propylene carbonate 1958.45
    n-methylformamide 259.38
    2-pentanol 2592.2
    n-pentane 5062.3
    1-propoxy-2-propanol 4966.1
    1-methoxy-2-propyl acetate 5099.96
    2-(2-methoxypropoxy) propanol 1553.47
    mesitylene 1972.7
    ε-caprolactone 4744.69
    p-cymene 3095.07
    epichlorohydrin 4542.11
    1,1,1-trichloroethane 6236.05
    2-aminoethanol 104.04
    morpholine-4-carbaldehyde 1877.58
    sulfolane 3287.75
    2,2,4-trimethylpentane 1941.84
    2-methyltetrahydrofuran 11960.82
    n-hexyl acetate 4555.87
    isooctane 1911.12
    2-(2-butoxyethoxy)ethanol 2273.19
    sec-butyl acetate 4074.63
    tert-butyl acetate 6452.73
    decalin 3637.15
    glycerin 94.19
    diglyme 5049.74
    acrylic acid 221.19
    isopropyl myristate 2617.35
    n-butyric acid 2010.53
    acetyl acetate 1784.6
    di(2-ethylhexyl) phthalate 844.34
    ethyl propionate 3684.75
    nitromethane 617.85
    1,2-diethoxyethane 10304.86
    benzonitrile 1378.58
    trioctyl phosphate 933.54
    1-bromopropane 8091.26
    gamma-valerolactone 3849.11
    n-decanol 1328.56
    triethyl phosphate 2279.57
    4-methyl-2-pentanol 2105.35
    propionitrile 1498.66
    vinylene carbonate 1046.54
    1,1,2-trichlorotrifluoroethane 1418.77
    DMS 1316.06
    cumene 1601.89
    2-octanol 1630.47
    2-hexanone 5216.42
    octyl acetate 2292.91
    limonene 7648.04
    1,2-dimethoxyethane 4897.4
    ethyl orthosilicate 2927.86
    tributyl phosphate 1339.65
    diacetone alcohol 2920.72
    N,N-dimethylaniline 1719.3
    acrylonitrile 828.4
    aniline 1548.88
    1,3-propanediol 345.51
    bromobenzene 3291.37
    dibromomethane 5203.47
    1,1,2,2-tetrachloroethane 5454.99
    2-methyl-cyclohexyl acetate 4674.87
    tetrabutyl urea 1739.92
    diisobutyl methanol 4894.14
    2-phenylethanol 1591.87
    styrene 2367.43
    dioctyl adipate 2256.25
    dimethyl sulfate 505.01
    ethyl butyrate 10296.23
    methyl lactate 350.29
    butyl lactate 1489.14
    diethyl carbonate 3942.78
    propanediol butyl ether 789.88
    triethyl orthoformate 7289.48
    p-tert-butyltoluene 3252.44
    methyl 4-tert-butylbenzoate 1659.42
    morpholine 5950.1
    tert-butylamine 3902.76
    n-dodecanol 1131.98
    dimethoxymethane 1784.37
    ethylene carbonate 1378.41
    cyrene 763.77
    2-ethoxyethyl acetate 3056.56
    2-ethylhexyl acetate 10589.47
    1,2,4-trichlorobenzene 2103.42
    4-methylpyridine 3818.44
    dibutyl ether 12224.42
    2,6-dimethyl-4-heptanol 4894.14
    DEF 3741.33
    dimethyl isosorbide 3059.88
    tetrachloroethylene 2939.29
    eugenol 971.33
    triacetin 2002.09
    span 80 1615.72
    1,4-butanediol 126.89
    1,1-dichloroethane 4982.22
    2-methyl-1-pentanol 2137.0
    methyl formate 200.72
    2-methyl-1-butanol 2253.53
    n-decane 2335.95
    butyronitrile 2853.87
    3,7-dimethyl-1-octanol 3123.5
    1-chlorooctane 4354.97
    1-chlorotetradecane 1476.29
    n-nonane 2836.72
    undecane 1447.55
    tert-butylcyclohexane 3045.41
    cyclooctane 5274.05
    cyclopentanol 2402.0
    tetrahydropyran 14539.26
    tert-amyl methyl ether 7027.86
    2,5,8-trioxanonane 2546.11
    1-hexene 10788.31
    2-isopropoxyethanol 1296.18
    2,2,2-trifluoroethanol 65.78
    methyl butyrate 4549.59

    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
Geranium phaeum (Serbia) Geranium phaeum L., fam. Geraniaceae 2.8%