N-Cyclohexyl-4-methylbenzenesulfonamide

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  • Identifiers

    CAS number
    80-30-8

    Molecular formula
    C13H19NO2S

    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Odorless 47.97%
    Cooked 25.07%
    Green 23.99%
    Roasted 22.85%
    Savory 21.17%
    Meaty 20.08%
    Pungent 17.83%
    Fruity 17.77%
    Fresh 17.27%
    Bitter 17.1%

    Scent© AI

  • Properties

    XLogP3-AA
    3.1

    Molecular weight
    253.36 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    406°C

    Melting point expt.

    • 183 to 185 °F (NTP, 1992)

    Flash point est.
    202.89 ˚C

    Solubility expt.

    • less than 1 mg/mL at 70 °F (NTP, 1992)

  • Synonyms

    • 80-30-8
    • N-CYCLOHEXYL-4-METHYLBENZENESULFONAMIDE
    • N-Cyclohexyl-p-toluenesulfonamide
    • Santicizer 1H
    • Benzenesulfonamide, N-cyclohexyl-4-methyl-
    • p-Toluenesulfonamide, N-cyclohexyl-
    • N-Cyclohexyltoluene-4-sulphonamide
    • (Tosylamino)cyclohexane
    • CCRIS 6008
    • N-cyclohexyl-4-methyl-benzenesulfonamide
    • UNII-0QPV1AE9EM
    • 0QPV1AE9EM
    • AI3-15119
    • EINECS 201-268-3
    • NSC 14856
    • BRN 2698317
    • N-Cyclohexyl-4-methyl benzenesulfonamide
    • DTXSID1024885
    • NSC-14856
    • N-cyclohexyl-4-methylbenzene-1-sulfonamide
    • MLS002152910
    • DTXCID404885
    • N-Cyclohexyl-4-toluenesulfonamide
    • 3-12-00-00061 (Beilstein Handbook Reference)
    • 4-Toluenesulfonamide, N-cyclohexyl-
    • SMR001224514
    • NSC14856
    • MFCD00014285
    • N-Cyclo Hexyl P-Toluene Sulphonamide
    • KETJENFLEX 1H
    • cid_6633
    • Oprea1_175608
    • Oprea1_267555
    • SCHEMBL128274
    • CHEMBL1371652
    • n-cyclohexyl p-toluenesulfonamide
    • BDBM74248
    • HMS3039A07
    • N-p-Toluenesulphonylcyclohexylamine
    • NSC48143
    • Tox21_200091
    • NSC-48143
    • STL137409
    • n-cyclohexyl-4-methylphenylsulfonamide
    • AKOS000384083
    • CAS-80-30-8
    • NCGC00091891-01
    • NCGC00091891-02
    • NCGC00257645-01
    • AS-64100
    • DB-056428
    • C2032
    • CS-0187582
    • NS00038072
    • 10.14272/DKYVVNLWACXMDW-UHFFFAOYSA-N
    • E76128
    • Benzenesulfonamide, N-cyclohexyl-4-methyl- (9CI)
    • doi:10.14272/DKYVVNLWACXMDW-UHFFFAOYSA-N
    • N-CYCLOHEXYL-4-METHYL-1-BENZENESULFONAMIDE
    • p-Toluenesulfonamide, N-cyclohexyl- (6CI,7CI,8CI)
    • Q27237113
    • Z45509354
    • 201-268-3

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 115.52
    methanol 109.23
    isopropanol 86.57
    water 0.06
    ethyl acetate 258.7
    n-propanol 111.69
    acetone 415.73
    n-butanol 96.41
    acetonitrile 231.17
    DMF 1030.64
    toluene 90.51
    isobutanol 63.05
    1,4-dioxane 336.25
    methyl acetate 299.98
    THF 546.38
    2-butanone 470.42
    n-pentanol 54.94
    sec-butanol 87.78
    n-hexane 1.03
    ethylene glycol 15.43
    NMP 605.1
    cyclohexane 9.01
    DMSO 325.11
    n-butyl acetate 144.63
    n-octanol 29.49
    chloroform 527.62
    n-propyl acetate 127.9
    acetic acid 100.99
    dichloromethane 441.97
    cyclohexanone 691.11
    propylene glycol 53.57
    isopropyl acetate 145.58
    DMAc 795.36
    2-ethoxyethanol 107.06
    isopentanol 67.28
    n-heptane 1.72
    ethyl formate 149.1
    1,2-dichloroethane 390.51
    n-hexanol 65.29
    2-methoxyethanol 243.78
    isobutyl acetate 67.34
    tetrachloromethane 14.75
    n-pentyl acetate 79.46
    transcutol 394.95
    n-heptanol 30.39
    ethylbenzene 35.02
    MIBK 124.26
    2-propoxyethanol 162.05
    tert-butanol 82.7
    MTBE 78.36
    2-butoxyethanol 76.24
    propionic acid 113.56
    o-xylene 46.25
    formic acid 33.23
    diethyl ether 102.08
    m-xylene 42.39
    p-xylene 48.33
    chlorobenzene 219.89
    dimethyl carbonate 97.22
    n-octane 1.29
    formamide 128.98
    cyclopentanone 805.33
    2-pentanone 292.24
    anisole 113.25
    cyclopentyl methyl ether 148.3
    gamma-butyrolactone 621.82
    1-methoxy-2-propanol 215.71
    pyridine 498.93
    3-pentanone 252.34
    furfural 427.51
    n-dodecane 1.74
    diethylene glycol 111.32
    diisopropyl ether 22.39
    tert-amyl alcohol 68.77
    acetylacetone 321.93
    n-hexadecane 2.13
    acetophenone 146.74
    methyl propionate 236.73
    isopentyl acetate 117.47
    trichloroethylene 757.92
    n-nonanol 29.57
    cyclohexanol 101.02
    benzyl alcohol 92.7
    2-ethylhexanol 36.74
    isooctanol 25.19
    dipropyl ether 35.83
    1,2-dichlorobenzene 174.02
    ethyl lactate 65.48
    propylene carbonate 290.83
    n-methylformamide 316.3
    2-pentanol 58.1
    n-pentane 1.77
    1-propoxy-2-propanol 120.19
    1-methoxy-2-propyl acetate 168.23
    2-(2-methoxypropoxy) propanol 102.05
    mesitylene 23.64
    ε-caprolactone 381.9
    p-cymene 24.45
    epichlorohydrin 620.04
    1,1,1-trichloroethane 184.04
    2-aminoethanol 57.59
    morpholine-4-carbaldehyde 455.92
    sulfolane 517.45
    2,2,4-trimethylpentane 1.89
    2-methyltetrahydrofuran 278.31
    n-hexyl acetate 100.11
    isooctane 1.54
    2-(2-butoxyethoxy)ethanol 139.7
    sec-butyl acetate 84.98
    tert-butyl acetate 128.27
    decalin 4.02
    glycerin 67.56
    diglyme 247.0
    acrylic acid 110.19
    isopropyl myristate 41.78
    n-butyric acid 158.71
    acetyl acetate 147.05
    di(2-ethylhexyl) phthalate 46.98
    ethyl propionate 114.31
    nitromethane 396.45
    1,2-diethoxyethane 131.25
    benzonitrile 184.13
    trioctyl phosphate 29.96
    1-bromopropane 117.37
    gamma-valerolactone 777.42
    n-decanol 23.78
    triethyl phosphate 43.34
    4-methyl-2-pentanol 32.9
    propionitrile 190.21
    vinylene carbonate 261.46
    1,1,2-trichlorotrifluoroethane 227.01
    DMS 127.75
    cumene 20.64
    2-octanol 23.63
    2-hexanone 137.61
    octyl acetate 53.73
    limonene 34.66
    1,2-dimethoxyethane 229.19
    ethyl orthosilicate 35.79
    tributyl phosphate 41.29
    diacetone alcohol 160.51
    N,N-dimethylaniline 60.84
    acrylonitrile 292.87
    aniline 133.29
    1,3-propanediol 94.91
    bromobenzene 209.51
    dibromomethane 256.48
    1,1,2,2-tetrachloroethane 579.15
    2-methyl-cyclohexyl acetate 81.2
    tetrabutyl urea 61.41
    diisobutyl methanol 23.35
    2-phenylethanol 98.62
    styrene 55.84
    dioctyl adipate 64.38
    dimethyl sulfate 140.29
    ethyl butyrate 92.6
    methyl lactate 118.47
    butyl lactate 77.89
    diethyl carbonate 62.66
    propanediol butyl ether 91.48
    triethyl orthoformate 56.18
    p-tert-butyltoluene 22.79
    methyl 4-tert-butylbenzoate 91.78
    morpholine 442.86
    tert-butylamine 37.83
    n-dodecanol 18.73
    dimethoxymethane 283.02
    ethylene carbonate 207.08
    cyrene 118.06
    2-ethoxyethyl acetate 138.35
    2-ethylhexyl acetate 93.19
    1,2,4-trichlorobenzene 198.6
    4-methylpyridine 368.21
    dibutyl ether 37.16
    2,6-dimethyl-4-heptanol 23.35
    DEF 343.78
    dimethyl isosorbide 197.92
    tetrachloroethylene 226.96
    eugenol 92.58
    triacetin 116.44
    span 80 85.9
    1,4-butanediol 30.18
    1,1-dichloroethane 282.88
    2-methyl-1-pentanol 48.11
    methyl formate 193.92
    2-methyl-1-butanol 62.88
    n-decane 2.42
    butyronitrile 174.25
    3,7-dimethyl-1-octanol 37.09
    1-chlorooctane 17.94
    1-chlorotetradecane 8.58
    n-nonane 1.88
    undecane 2.04
    tert-butylcyclohexane 2.66
    cyclooctane 2.05
    cyclopentanol 132.44
    tetrahydropyran 327.51
    tert-amyl methyl ether 60.6
    2,5,8-trioxanonane 175.43
    1-hexene 11.45
    2-isopropoxyethanol 72.22
    2,2,2-trifluoroethanol 42.36
    methyl butyrate 168.85

    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