2-Phenylpropan-2-yl formate

Overview IFRA Request a quote

  • Identifiers

    Molecular formula
    C10H12O2

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

  • Odor profile

    Fruity 78.56%
    Floral 78.06%
    Green 58.99%
    Herbal 53.33%
    Fresh 43.68%
    Jasmin 34.48%
    Spicy 33.91%
    Woody 32.78%
    Tropical 28.89%
    Sweet 28.52%

    Scent© AI

  • Properties

    XLogP3-AA
    2.2

    Molecular weight
    164.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    232°C

    Flash point est.
    87.13 ˚C

  • Synonyms

    • SCHEMBL135668

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 335.86
    methanol 423.73
    isopropanol 192.2
    water 1.37
    ethyl acetate 598.93
    n-propanol 267.81
    acetone 1026.52
    n-butanol 190.61
    acetonitrile 783.85
    DMF 1234.42
    toluene 302.95
    isobutanol 166.83
    1,4-dioxane 983.71
    methyl acetate 758.18
    THF 1429.22
    2-butanone 838.87
    n-pentanol 143.26
    sec-butanol 198.62
    n-hexane 50.46
    ethylene glycol 95.97
    NMP 1353.46
    cyclohexane 59.07
    DMSO 1584.3
    n-butyl acetate 357.51
    n-octanol 109.79
    chloroform 1469.81
    n-propyl acetate 328.57
    acetic acid 323.87
    dichloromethane 1821.95
    cyclohexanone 1063.3
    propylene glycol 105.12
    isopropyl acetate 276.68
    DMAc 790.01
    2-ethoxyethanol 290.36
    isopentanol 165.42
    n-heptane 23.3
    ethyl formate 383.85
    1,2-dichloroethane 1373.46
    n-hexanol 201.52
    2-methoxyethanol 463.77
    isobutyl acetate 166.45
    tetrachloromethane 182.41
    n-pentyl acetate 176.98
    transcutol 1120.22
    n-heptanol 85.69
    ethylbenzene 191.08
    MIBK 249.74
    2-propoxyethanol 357.02
    tert-butanol 263.98
    MTBE 296.55
    2-butoxyethanol 171.03
    propionic acid 390.67
    o-xylene 187.56
    formic acid 158.22
    diethyl ether 462.15
    m-xylene 191.78
    p-xylene 204.53
    chlorobenzene 529.73
    dimethyl carbonate 274.33
    n-octane 9.52
    formamide 375.65
    cyclopentanone 1433.83
    2-pentanone 562.84
    anisole 427.81
    cyclopentyl methyl ether 583.78
    gamma-butyrolactone 1646.78
    1-methoxy-2-propanol 354.86
    pyridine 736.47
    3-pentanone 538.61
    furfural 980.18
    n-dodecane 7.59
    diethylene glycol 258.34
    diisopropyl ether 103.27
    tert-amyl alcohol 239.21
    acetylacetone 598.37
    n-hexadecane 9.06
    acetophenone 353.75
    methyl propionate 598.12
    isopentyl acetate 276.73
    trichloroethylene 2052.24
    n-nonanol 87.48
    cyclohexanol 254.88
    benzyl alcohol 227.91
    2-ethylhexanol 121.13
    isooctanol 68.59
    dipropyl ether 176.61
    1,2-dichlorobenzene 461.09
    ethyl lactate 147.86
    propylene carbonate 705.9
    n-methylformamide 720.79
    2-pentanol 139.38
    n-pentane 31.7
    1-propoxy-2-propanol 239.88
    1-methoxy-2-propyl acetate 337.29
    2-(2-methoxypropoxy) propanol 217.47
    mesitylene 112.63
    ε-caprolactone 809.24
    p-cymene 85.97
    epichlorohydrin 1696.71
    1,1,1-trichloroethane 839.39
    2-aminoethanol 158.02
    morpholine-4-carbaldehyde 902.44
    sulfolane 1862.89
    2,2,4-trimethylpentane 18.87
    2-methyltetrahydrofuran 996.03
    n-hexyl acetate 300.26
    isooctane 13.81
    2-(2-butoxyethoxy)ethanol 296.37
    sec-butyl acetate 204.33
    tert-butyl acetate 303.41
    decalin 41.55
    glycerin 156.03
    diglyme 595.42
    acrylic acid 345.5
    isopropyl myristate 102.15
    n-butyric acid 372.56
    acetyl acetate 305.55
    di(2-ethylhexyl) phthalate 94.14
    ethyl propionate 329.9
    nitromethane 1102.31
    1,2-diethoxyethane 325.83
    benzonitrile 359.4
    trioctyl phosphate 71.61
    1-bromopropane 545.5
    gamma-valerolactone 1321.33
    n-decanol 64.63
    triethyl phosphate 124.56
    4-methyl-2-pentanol 80.65
    propionitrile 460.66
    vinylene carbonate 580.33
    1,1,2-trichlorotrifluoroethane 623.77
    DMS 348.18
    cumene 110.67
    2-octanol 66.41
    2-hexanone 370.49
    octyl acetate 131.39
    limonene 119.88
    1,2-dimethoxyethane 566.96
    ethyl orthosilicate 108.54
    tributyl phosphate 100.41
    diacetone alcohol 322.79
    N,N-dimethylaniline 245.67
    acrylonitrile 628.75
    aniline 345.41
    1,3-propanediol 201.44
    bromobenzene 565.77
    dibromomethane 1073.54
    1,1,2,2-tetrachloroethane 1377.68
    2-methyl-cyclohexyl acetate 196.44
    tetrabutyl urea 134.37
    diisobutyl methanol 69.61
    2-phenylethanol 227.31
    styrene 252.69
    dioctyl adipate 159.21
    dimethyl sulfate 520.65
    ethyl butyrate 241.73
    methyl lactate 227.08
    butyl lactate 145.74
    diethyl carbonate 181.9
    propanediol butyl ether 195.04
    triethyl orthoformate 148.66
    p-tert-butyltoluene 84.1
    methyl 4-tert-butylbenzoate 236.19
    morpholine 1036.88
    tert-butylamine 160.46
    n-dodecanol 47.16
    dimethoxymethane 554.0
    ethylene carbonate 467.04
    cyrene 262.84
    2-ethoxyethyl acetate 274.79
    2-ethylhexyl acetate 229.22
    1,2,4-trichlorobenzene 535.35
    4-methylpyridine 741.86
    dibutyl ether 148.75
    2,6-dimethyl-4-heptanol 69.61
    DEF 605.6
    dimethyl isosorbide 451.89
    tetrachloroethylene 791.52
    eugenol 212.47
    triacetin 277.13
    span 80 176.72
    1,4-butanediol 85.91
    1,1-dichloroethane 1046.33
    2-methyl-1-pentanol 142.67
    methyl formate 589.14
    2-methyl-1-butanol 166.75
    n-decane 13.65
    butyronitrile 356.81
    3,7-dimethyl-1-octanol 106.72
    1-chlorooctane 89.11
    1-chlorotetradecane 30.3
    n-nonane 13.96
    undecane 9.93
    tert-butylcyclohexane 35.02
    cyclooctane 21.17
    cyclopentanol 338.67
    tetrahydropyran 891.64
    tert-amyl methyl ether 246.37
    2,5,8-trioxanonane 367.5
    1-hexene 168.55
    2-isopropoxyethanol 204.79
    2,2,2-trifluoroethanol 177.42
    methyl butyrate 433.39

    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