Benzenesulfonic acid, tridecyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)

Overview IFRA Request a quote

  • Identifiers

    CAS number
    61886-59-7

    Molecular formula
    C25H46NO6S-

    SMILES
    CCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C(CO)N(CCO)CCO

    Safety labels

  • Odor profile

    Fragrance
    Odorless 43.46%
    Fatty 43.43%
    Waxy 38.67%
    Oily 24.27%
    Citrus 22.91%
    Fresh 21.33%
    Savory 20.82%
    Animal 19.84%
    Meaty 19.82%
    Milky 18.17%

     

    Flavor
    Bitter 25.74%
    Herbal 22.69%
    Mild 21.2%
    Bland 21.15%
    Low 19.19%
    Diterpene 19.17%
    Slightly waxy 19.08%
    Lovage 18.9%
    Delicate 18.84%
    Cedarleaf 18.75%

     

    Odor impact est.
    Low

  • Properties

    pKa est.
    6.02 (neutral)

    Molecular weight
    488.7 g/mol

    Flash point

    • 198.04 ˚C est.

  • Synonyms

    • Triethanolamine tridecylbenzenesulfonate
    • EINECS 263-296-2
    • 61886-59-7
    • RefChem:118085
    • TEA-Tridecylbenzenesulfonate
    • Tridecylbenzenesulphonic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
    • 61886-59-7

  • Applications

    Benzenesulfonic acid, tridecyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) (CAS 61886-59-7) is an anionic surfactant complex with triethanolamine, used as a surface-active and emulsifying agent in various formulations. Real-world applications include: 1) as a surfactant in household and industrial cleaning products to improve detergency and wetting; 2) as an emulsifier, wetting agent, and dispersant in coatings, inks, and polymer formulations; 3) as a processing aid in polymer and plastics manufacturing to stabilize emulsions and enhance dispersion; 4) as a component in cosmetic/personal care products as a cleansing surfactant; 5) as an additive in industrial cleaners and solvent systems to aid emulsification and soil removal.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 200.61
    methanol 175.87
    isopropanol 150.2
    water 0.06
    ethyl acetate 317.09
    n-propanol 218.71
    acetone 515.55
    n-butanol 165.81
    acetonitrile 193.78
    DMF 1101.87
    toluene 232.94
    isobutanol 132.25
    1,4-dioxane 353.52
    methyl acetate 278.04
    THF 1010.5
    2-butanone 476.83
    n-pentanol 106.62
    sec-butanol 165.0
    n-hexane 8.68
    ethylene glycol 15.73
    NMP 1393.92
    cyclohexane 49.69
    DMSO 725.55
    n-butyl acetate 244.13
    n-octanol 51.26
    chloroform 888.56
    n-propyl acetate 236.59
    acetic acid 145.09
    dichloromethane 1013.59
    cyclohexanone 1099.61
    propylene glycol 53.98
    isopropyl acetate 237.97
    DMAc 982.62
    2-ethoxyethanol 172.45
    isopentanol 119.48
    n-heptane 6.93
    ethyl formate 171.13
    1,2-dichloroethane 906.51
    n-hexanol 89.56
    2-methoxyethanol 285.45
    isobutyl acetate 141.28
    tetrachloromethane 104.77
    n-pentyl acetate 238.22
    transcutol 514.5
    n-heptanol 59.08
    ethylbenzene 89.28
    MIBK 232.57
    2-propoxyethanol 195.91
    tert-butanol 141.65
    MTBE 181.23
    2-butoxyethanol 152.17
    propionic acid 178.56
    o-xylene 138.16
    formic acid 38.23
    diethyl ether 203.78
    m-xylene 127.09
    p-xylene 112.59
    chlorobenzene 438.39
    dimethyl carbonate 131.04
    n-octane 4.86
    formamide 144.11
    cyclopentanone 1238.88
    2-pentanone 406.33
    anisole 226.56
    cyclopentyl methyl ether 421.86
    gamma-butyrolactone 974.94
    1-methoxy-2-propanol 260.3
    pyridine 742.58
    3-pentanone 331.5
    furfural 679.55
    n-dodecane 3.77
    diethylene glycol 93.92
    diisopropyl ether 60.31
    tert-amyl alcohol 147.14
    acetylacetone 490.22
    n-hexadecane 4.68
    acetophenone 282.9
    methyl propionate 300.18
    isopentyl acetate 213.49
    trichloroethylene 1550.31
    n-nonanol 52.26
    cyclohexanol 223.19
    benzyl alcohol 175.06
    2-ethylhexanol 61.64
    isooctanol 55.67
    dipropyl ether 86.63
    1,2-dichlorobenzene 440.45
    ethyl lactate 101.6
    propylene carbonate 472.87
    n-methylformamide 353.32
    2-pentanol 100.81
    n-pentane 12.17
    1-propoxy-2-propanol 159.7
    1-methoxy-2-propyl acetate 257.09
    2-(2-methoxypropoxy) propanol 135.16
    mesitylene 75.58
    ε-caprolactone 730.47
    p-cymene 51.17
    epichlorohydrin 1142.82
    1,1,1-trichloroethane 596.25
    2-aminoethanol 78.03
    morpholine-4-carbaldehyde 778.36
    sulfolane 1322.3
    2,2,4-trimethylpentane 8.8
    2-methyltetrahydrofuran 623.32
    n-hexyl acetate 223.05
    isooctane 5.89
    2-(2-butoxyethoxy)ethanol 191.8
    sec-butyl acetate 163.56
    tert-butyl acetate 278.59
    decalin 18.11
    glycerin 61.47
    diglyme 402.23
    acrylic acid 137.48
    isopropyl myristate 71.18
    n-butyric acid 266.72
    acetyl acetate 186.55
    di(2-ethylhexyl) phthalate 74.94
    ethyl propionate 188.94
    nitromethane 450.98
    1,2-diethoxyethane 234.65
    benzonitrile 281.09
    trioctyl phosphate 50.35
    1-bromopropane 376.54
    gamma-valerolactone 1277.66
    n-decanol 36.66
    triethyl phosphate 78.58
    4-methyl-2-pentanol 55.45
    propionitrile 207.95
    vinylene carbonate 376.3
    1,1,2-trichlorotrifluoroethane 515.85
    DMS 200.87
    cumene 52.47
    2-octanol 48.06
    2-hexanone 256.96
    octyl acetate 95.24
    limonene 90.69
    1,2-dimethoxyethane 332.61
    ethyl orthosilicate 74.0
    tributyl phosphate 66.03
    diacetone alcohol 276.44
    N,N-dimethylaniline 145.93
    acrylonitrile 280.13
    aniline 263.83
    1,3-propanediol 114.86
    bromobenzene 481.44
    dibromomethane 657.96
    1,1,2,2-tetrachloroethane 1164.83
    2-methyl-cyclohexyl acetate 159.83
    tetrabutyl urea 110.88
    diisobutyl methanol 41.32
    2-phenylethanol 148.17
    styrene 137.06
    dioctyl adipate 121.49
    dimethyl sulfate 284.94
    ethyl butyrate 161.71
    methyl lactate 136.2
    butyl lactate 166.94
    diethyl carbonate 97.71
    propanediol butyl ether 133.44
    triethyl orthoformate 107.92
    p-tert-butyltoluene 50.21
    methyl 4-tert-butylbenzoate 196.7
    morpholine 605.99
    tert-butylamine 85.07
    n-dodecanol 26.77
    dimethoxymethane 369.83
    ethylene carbonate 319.55
    cyrene 203.62
    2-ethoxyethyl acetate 316.69
    2-ethylhexyl acetate 175.35
    1,2,4-trichlorobenzene 497.75
    4-methylpyridine 679.42
    dibutyl ether 82.78
    2,6-dimethyl-4-heptanol 41.32
    DEF 554.54
    dimethyl isosorbide 338.35
    tetrachloroethylene 649.99
    eugenol 175.58
    triacetin 230.45
    span 80 136.65
    1,4-butanediol 42.98
    1,1-dichloroethane 646.75
    2-methyl-1-pentanol 95.94
    methyl formate 185.55
    2-methyl-1-butanol 127.28
    n-decane 7.01
    butyronitrile 216.25
    3,7-dimethyl-1-octanol 57.66
    1-chlorooctane 51.2
    1-chlorotetradecane 18.27
    n-nonane 5.99
    undecane 4.89
    tert-butylcyclohexane 11.78
    cyclooctane 11.04
    cyclopentanol 276.62
    tetrahydropyran 575.0
    tert-amyl methyl ether 151.47
    2,5,8-trioxanonane 243.69
    1-hexene 52.0
    2-isopropoxyethanol 127.06
    2,2,2-trifluoroethanol 69.9
    methyl butyrate 285.33

    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