1-(Cyclopropylmethyl)-2-methoxybenzene

  • Identifiers

    Molecular formula
    C11H14O

    SMILES
    COC1=CC=CC=C1CC2CC2

  • Odor profile

    Fragrance
    Spicy 51.4%
    Herbal 39.5%
    Anisic 36.9%
    Sweet 34.53%
    Earthy 32.38%
    Floral 31.5%
    Woody 31.19%
    Animal 30.83%
    Balsamic 29.39%
    Phenolic 27.81%

     

    Flavor
    Sweet 47.08%
    Balsam 38.05%
    Fruity 36.49%
    Earthy 36.08%
    Green 32.94%
    Rose 30.58%
    Herbal 28.92%
    Musty 28.75%
    Spicy 28.02%
    Spice 26.94%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.8

    pKa est.
    7.59 (neutral)

    Molecular weight
    162.23 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    245°C

    Flash point

    • 74.17 ˚C est.

  • Synonyms

    • SCHEMBL23886286
  • Applications

    1-(Cyclopropylmethyl)-2-methoxybenzene is typically considered an organic synthesis intermediate and may find applications across several industries: as a building block for fragrance ingredients and cosmetic formulations; as a precursor in pharmaceutical synthesis; as an intermediate for the development of agrochemicals; evaluated for use in research and development of specialty aryl compounds for industrial materials; and as a building block in synthetic routes to produce more complex aromatic compounds.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1042.2
    methanol 739.77
    isopropanol 572.44
    water 0.23
    ethyl acetate 901.4
    n-propanol 715.74
    acetone 933.82
    n-butanol 644.21
    acetonitrile 1007.32
    DMF 562.73
    toluene 688.14
    isobutanol 447.11
    1,4-dioxane 1525.02
    methyl acetate 818.98
    THF 1507.99
    2-butanone 801.21
    n-pentanol 460.95
    sec-butanol 478.08
    n-hexane 95.27
    ethylene glycol 145.55
    NMP 400.43
    cyclohexane 251.57
    DMSO 766.66
    n-butyl acetate 907.79
    n-octanol 242.35
    chloroform 3695.39
    n-propyl acetate 671.94
    acetic acid 695.5
    dichloromethane 4668.36
    cyclohexanone 1148.9
    propylene glycol 179.84
    isopropyl acetate 454.67
    DMAc 391.08
    2-ethoxyethanol 605.75
    isopentanol 432.68
    n-heptane 133.15
    ethyl formate 714.35
    1,2-dichloroethane 2066.55
    n-hexanol 545.99
    2-methoxyethanol 770.82
    isobutyl acetate 374.84
    tetrachloromethane 476.84
    n-pentyl acetate 357.97
    transcutol 1558.24
    n-heptanol 208.64
    ethylbenzene 320.76
    MIBK 344.1
    2-propoxyethanol 731.3
    tert-butanol 502.72
    MTBE 503.23
    2-butoxyethanol 361.96
    propionic acid 504.98
    o-xylene 284.15
    formic acid 137.07
    diethyl ether 831.05
    m-xylene 317.64
    p-xylene 346.56
    chlorobenzene 892.58
    dimethyl carbonate 227.7
    n-octane 50.91
    formamide 286.4
    cyclopentanone 1052.92
    2-pentanone 654.6
    anisole 567.17
    cyclopentyl methyl ether 595.17
    gamma-butyrolactone 1138.87
    1-methoxy-2-propanol 493.58
    pyridine 1733.95
    3-pentanone 465.05
    furfural 943.55
    n-dodecane 42.68
    diethylene glycol 440.69
    diisopropyl ether 196.85
    tert-amyl alcohol 399.91
    acetylacetone 622.73
    n-hexadecane 48.51
    acetophenone 462.41
    methyl propionate 507.76
    isopentyl acetate 634.88
    trichloroethylene 3197.83
    n-nonanol 208.14
    cyclohexanol 516.32
    benzyl alcohol 450.14
    2-ethylhexanol 334.13
    isooctanol 178.06
    dipropyl ether 525.49
    1,2-dichlorobenzene 675.93
    ethyl lactate 224.57
    propylene carbonate 708.15
    n-methylformamide 445.42
    2-pentanol 345.66
    n-pentane 105.58
    1-propoxy-2-propanol 499.47
    1-methoxy-2-propyl acetate 528.63
    2-(2-methoxypropoxy) propanol 313.57
    mesitylene 183.67
    ε-caprolactone 869.68
    p-cymene 207.68
    epichlorohydrin 1684.38
    1,1,1-trichloroethane 1469.7
    2-aminoethanol 288.69
    morpholine-4-carbaldehyde 662.74
    sulfolane 794.54
    2,2,4-trimethylpentane 47.48
    2-methyltetrahydrofuran 1030.08
    n-hexyl acetate 448.54
    isooctane 48.89
    2-(2-butoxyethoxy)ethanol 468.08
    sec-butyl acetate 348.59
    tert-butyl acetate 375.47
    decalin 88.97
    glycerin 194.35
    diglyme 975.72
    acrylic acid 389.74
    isopropyl myristate 195.56
    n-butyric acid 777.34
    acetyl acetate 507.27
    di(2-ethylhexyl) phthalate 164.97
    ethyl propionate 462.12
    nitromethane 960.67
    1,2-diethoxyethane 773.94
    benzonitrile 728.49
    trioctyl phosphate 120.9
    1-bromopropane 1214.7
    gamma-valerolactone 1056.82
    n-decanol 160.22
    triethyl phosphate 190.59
    4-methyl-2-pentanol 181.43
    propionitrile 799.46
    vinylene carbonate 706.27
    1,1,2-trichlorotrifluoroethane 694.38
    DMS 351.0
    cumene 183.07
    2-octanol 146.13
    2-hexanone 533.37
    octyl acetate 237.21
    limonene 281.28
    1,2-dimethoxyethane 1076.78
    ethyl orthosilicate 187.03
    tributyl phosphate 162.08
    diacetone alcohol 342.66
    N,N-dimethylaniline 276.34
    acrylonitrile 888.84
    aniline 537.38
    1,3-propanediol 463.57
    bromobenzene 1071.77
    dibromomethane 3005.32
    1,1,2,2-tetrachloroethane 1939.08
    2-methyl-cyclohexyl acetate 323.98
    tetrabutyl urea 196.19
    diisobutyl methanol 198.69
    2-phenylethanol 427.2
    styrene 469.98
    dioctyl adipate 271.16
    dimethyl sulfate 242.75
    ethyl butyrate 587.76
    methyl lactate 197.64
    butyl lactate 222.02
    diethyl carbonate 395.13
    propanediol butyl ether 282.71
    triethyl orthoformate 323.82
    p-tert-butyltoluene 182.06
    methyl 4-tert-butylbenzoate 296.92
    morpholine 1398.7
    tert-butylamine 349.59
    n-dodecanol 132.33
    dimethoxymethane 618.69
    ethylene carbonate 638.93
    cyrene 273.29
    2-ethoxyethyl acetate 484.71
    2-ethylhexyl acetate 498.48
    1,2,4-trichlorobenzene 652.61
    4-methylpyridine 1161.91
    dibutyl ether 397.73
    2,6-dimethyl-4-heptanol 198.69
    DEF 528.23
    dimethyl isosorbide 503.27
    tetrachloroethylene 1347.33
    eugenol 287.72
    triacetin 374.05
    span 80 268.78
    1,4-butanediol 217.85
    1,1-dichloroethane 1803.5
    2-methyl-1-pentanol 354.62
    methyl formate 397.73
    2-methyl-1-butanol 390.09
    n-decane 68.49
    butyronitrile 958.04
    3,7-dimethyl-1-octanol 238.6
    1-chlorooctane 237.32
    1-chlorotetradecane 103.72
    n-nonane 71.34
    undecane 51.94
    tert-butylcyclohexane 74.42
    cyclooctane 83.62
    cyclopentanol 479.88
    tetrahydropyran 1426.43
    tert-amyl methyl ether 300.67
    2,5,8-trioxanonane 580.43
    1-hexene 337.21
    2-isopropoxyethanol 408.12
    2,2,2-trifluoroethanol 178.58
    methyl butyrate 657.2

    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