1-(4-Isopropylphenyl)-2-methylpropan-2-ol

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  • Identifiers

    CAS number
    41342-91-0

    Molecular formula
    C13H20O

    SMILES
    CC(C)C1=CC=C(C=C1)CC(C)(C)O

  • Odor profile

    Floral 81.31%
    Herbal 65.67%
    Green 63.41%
    Fresh 56.25%
    Citrus 48.76%
    Lily 47.1%
    Muguet 44.68%
    Rose 42.2%
    Woody 41.57%
    Lemon 36.97%

    Scent© AI

  • Properties

    XLogP3-AA
    3.2

    Molecular weight
    192.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    260°C

    Flash point est.
    116.48 ˚C

  • Synonyms

    • 41342-91-0
    • 1-(4-isopropylphenyl)-2-methylpropan-2-ol
    • 1-(4-iso-Propylphenyl)-2-methyl-2-propanol
    • starbld0015985
    • 1-(4-isopropyl-phenyl)-2-methyl-propan-2-ol
    • SCHEMBL247421
    • UCMLFRCVHNLWOH-UHFFFAOYSA-N
    • AKOS006272519
    • DB-121012
    • 2-methyl-1-(4-propan-2-ylphenyl)propan-2-ol
    • EN300-1827846
    • 2-methyl-1-[4-(propan-2-yl)phenyl]propan-2-ol

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1008.85
    methanol 880.15
    isopropanol 1002.11
    water 0.41
    ethyl acetate 879.61
    n-propanol 860.49
    acetone 1123.89
    n-butanol 903.94
    acetonitrile 566.31
    DMF 1031.65
    toluene 344.01
    isobutanol 714.92
    1,4-dioxane 1488.0
    methyl acetate 858.18
    THF 2167.86
    2-butanone 896.49
    n-pentanol 693.77
    sec-butanol 742.15
    n-hexane 664.0
    ethylene glycol 172.69
    NMP 652.91
    cyclohexane 321.44
    DMSO 668.27
    n-butyl acetate 978.0
    n-octanol 595.05
    chloroform 1126.73
    n-propyl acetate 514.16
    acetic acid 404.75
    dichloromethane 668.36
    cyclohexanone 935.81
    propylene glycol 397.62
    isopropyl acetate 677.56
    DMAc 997.51
    2-ethoxyethanol 691.96
    isopentanol 847.04
    n-heptane 355.2
    ethyl formate 354.43
    1,2-dichloroethane 581.68
    n-hexanol 1654.85
    2-methoxyethanol 1043.69
    isobutyl acetate 458.28
    tetrachloromethane 205.73
    n-pentyl acetate 421.1
    transcutol 2350.5
    n-heptanol 516.53
    ethylbenzene 244.3
    MIBK 658.11
    2-propoxyethanol 1733.78
    tert-butanol 1543.12
    MTBE 1850.0
    2-butoxyethanol 665.87
    propionic acid 461.19
    o-xylene 233.52
    formic acid 98.85
    diethyl ether 1431.72
    m-xylene 307.84
    p-xylene 304.2
    chlorobenzene 349.36
    dimethyl carbonate 276.44
    n-octane 139.3
    formamide 122.1
    cyclopentanone 1023.65
    2-pentanone 859.19
    anisole 484.46
    cyclopentyl methyl ether 1106.63
    gamma-butyrolactone 843.68
    1-methoxy-2-propanol 1101.84
    pyridine 508.68
    3-pentanone 670.79
    furfural 564.71
    n-dodecane 98.77
    diethylene glycol 831.51
    diisopropyl ether 634.77
    tert-amyl alcohol 984.22
    acetylacetone 752.49
    n-hexadecane 109.87
    acetophenone 336.39
    methyl propionate 697.6
    isopentyl acetate 905.3
    trichloroethylene 876.17
    n-nonanol 503.46
    cyclohexanol 715.31
    benzyl alcohol 314.59
    2-ethylhexanol 857.67
    isooctanol 409.04
    dipropyl ether 1220.42
    1,2-dichlorobenzene 302.33
    ethyl lactate 275.27
    propylene carbonate 531.47
    n-methylformamide 349.87
    2-pentanol 773.22
    n-pentane 342.23
    1-propoxy-2-propanol 1347.9
    1-methoxy-2-propyl acetate 1001.02
    2-(2-methoxypropoxy) propanol 597.38
    mesitylene 218.63
    ε-caprolactone 756.36
    p-cymene 209.58
    epichlorohydrin 983.46
    1,1,1-trichloroethane 711.5
    2-aminoethanol 393.11
    morpholine-4-carbaldehyde 1031.68
    sulfolane 769.8
    2,2,4-trimethylpentane 149.13
    2-methyltetrahydrofuran 1448.56
    n-hexyl acetate 805.6
    isooctane 162.59
    2-(2-butoxyethoxy)ethanol 918.44
    sec-butyl acetate 450.73
    tert-butyl acetate 885.29
    decalin 188.91
    glycerin 386.33
    diglyme 1346.44
    acrylic acid 266.57
    isopropyl myristate 333.32
    n-butyric acid 705.04
    acetyl acetate 419.42
    di(2-ethylhexyl) phthalate 231.04
    ethyl propionate 484.88
    nitromethane 549.17
    1,2-diethoxyethane 1099.44
    benzonitrile 337.75
    trioctyl phosphate 203.55
    1-bromopropane 616.15
    gamma-valerolactone 1125.76
    n-decanol 393.79
    triethyl phosphate 220.38
    4-methyl-2-pentanol 573.16
    propionitrile 543.5
    vinylene carbonate 394.85
    1,1,2-trichlorotrifluoroethane 623.73
    DMS 484.56
    cumene 208.41
    2-octanol 352.12
    2-hexanone 672.83
    octyl acetate 422.55
    limonene 377.35
    1,2-dimethoxyethane 1237.29
    ethyl orthosilicate 249.71
    tributyl phosphate 257.11
    diacetone alcohol 856.27
    N,N-dimethylaniline 348.4
    acrylonitrile 417.85
    aniline 384.07
    1,3-propanediol 510.42
    bromobenzene 351.34
    dibromomethane 565.01
    1,1,2,2-tetrachloroethane 914.22
    2-methyl-cyclohexyl acetate 478.17
    tetrabutyl urea 311.28
    diisobutyl methanol 408.68
    2-phenylethanol 526.21
    styrene 253.6
    dioctyl adipate 364.22
    dimethyl sulfate 332.22
    ethyl butyrate 573.28
    methyl lactate 362.66
    butyl lactate 356.35
    diethyl carbonate 309.4
    propanediol butyl ether 656.91
    triethyl orthoformate 423.57
    p-tert-butyltoluene 239.47
    methyl 4-tert-butylbenzoate 383.18
    morpholine 1589.85
    tert-butylamine 1142.11
    n-dodecanol 318.84
    dimethoxymethane 996.5
    ethylene carbonate 398.52
    cyrene 383.9
    2-ethoxyethyl acetate 562.88
    2-ethylhexyl acetate 686.2
    1,2,4-trichlorobenzene 349.85
    4-methylpyridine 646.17
    dibutyl ether 867.04
    2,6-dimethyl-4-heptanol 408.68
    DEF 734.53
    dimethyl isosorbide 789.16
    tetrachloroethylene 519.49
    eugenol 355.04
    triacetin 536.28
    span 80 586.97
    1,4-butanediol 260.89
    1,1-dichloroethane 765.89
    2-methyl-1-pentanol 593.64
    methyl formate 290.58
    2-methyl-1-butanol 676.99
    n-decane 176.25
    butyronitrile 644.43
    3,7-dimethyl-1-octanol 582.95
    1-chlorooctane 438.33
    1-chlorotetradecane 187.54
    n-nonane 194.0
    undecane 127.61
    tert-butylcyclohexane 225.67
    cyclooctane 154.19
    cyclopentanol 631.7
    tetrahydropyran 1571.06
    tert-amyl methyl ether 1095.73
    2,5,8-trioxanonane 836.56
    1-hexene 1064.54
    2-isopropoxyethanol 627.46
    2,2,2-trifluoroethanol 124.48
    methyl butyrate 542.65

    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