Cyclohexyl benzoate

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    2412-73-9

    Molecular formula
    C13H16O2

    SMILES
    C1CCC(CC1)OC(=O)C2=CC=CC=C2

  • Odor profile

    Fruity 80.33%
    Balsamic 72.17%
    Floral 72.08%
    Herbal 62.59%
    Sweet 51.81%
    Green 46.87%
    Rose 35.29%
    Jasmin 34.57%
    Woody 34.06%
    Oily 28.67%

    Scent© AI

  • Properties

    XLogP3-AA
    3.6

    Molecular weight
    204.26 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    289°C

    Flash point est.
    130.07 ˚C

  • Synonyms

    • Cyclohexyl benzoate
    • 2412-73-9
    • Benzoic acid, cyclohexyl ester
    • D78VJ3UF7P
    • Hexahydrophenyl benzoate
    • EINECS 219-319-3
    • AI3-02126
    • DTXSID90178843
    • cyclohexylbenzoate
    • 4-benzoyloxy-cyclohexane
    • UNII-D78VJ3UF7P
    • benzoic acid cyclohexyl ester
    • SCHEMBL60478
    • DTXCID50101334
    • MFCD00234842
    • AKOS003456717
    • AS-82687
    • NS00027563
    • E84465
    • 219-319-3

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 553.29
    methanol 454.69
    isopropanol 421.43
    water 0.21
    ethyl acetate 729.74
    n-propanol 506.79
    acetone 1076.79
    n-butanol 529.41
    acetonitrile 818.49
    DMF 1684.35
    toluene 420.42
    isobutanol 456.98
    1,4-dioxane 926.73
    methyl acetate 661.9
    THF 1005.24
    2-butanone 890.96
    n-pentanol 314.25
    sec-butanol 440.36
    n-hexane 67.11
    ethylene glycol 47.79
    NMP 927.73
    cyclohexane 143.59
    DMSO 754.14
    n-butyl acetate 641.83
    n-octanol 204.72
    chloroform 2884.6
    n-propyl acetate 514.75
    acetic acid 553.18
    dichloromethane 2511.29
    cyclohexanone 1426.88
    propylene glycol 97.9
    isopropyl acetate 428.75
    DMAc 1210.47
    2-ethoxyethanol 326.23
    isopentanol 462.14
    n-heptane 30.48
    ethyl formate 526.59
    1,2-dichloroethane 1861.94
    n-hexanol 358.02
    2-methoxyethanol 578.28
    isobutyl acetate 310.15
    tetrachloromethane 157.0
    n-pentyl acetate 359.58
    transcutol 1676.72
    n-heptanol 174.35
    ethylbenzene 273.51
    MIBK 398.99
    2-propoxyethanol 449.69
    tert-butanol 379.54
    MTBE 408.95
    2-butoxyethanol 302.26
    propionic acid 448.8
    o-xylene 231.42
    formic acid 110.36
    diethyl ether 588.31
    m-xylene 221.13
    p-xylene 344.09
    chlorobenzene 965.26
    dimethyl carbonate 252.0
    n-octane 21.03
    formamide 285.36
    cyclopentanone 1267.88
    2-pentanone 739.51
    anisole 511.36
    cyclopentyl methyl ether 474.17
    gamma-butyrolactone 1208.6
    1-methoxy-2-propanol 453.71
    pyridine 1568.43
    3-pentanone 545.0
    furfural 1165.76
    n-dodecane 21.59
    diethylene glycol 244.51
    diisopropyl ether 141.28
    tert-amyl alcohol 366.34
    acetylacetone 657.71
    n-hexadecane 25.43
    acetophenone 510.5
    methyl propionate 534.78
    isopentyl acetate 529.31
    trichloroethylene 3374.67
    n-nonanol 177.72
    cyclohexanol 493.34
    benzyl alcohol 371.68
    2-ethylhexanol 228.46
    isooctanol 155.98
    dipropyl ether 239.51
    1,2-dichlorobenzene 806.63
    ethyl lactate 191.52
    propylene carbonate 749.7
    n-methylformamide 604.06
    2-pentanol 344.15
    n-pentane 47.91
    1-propoxy-2-propanol 356.0
    1-methoxy-2-propyl acetate 400.66
    2-(2-methoxypropoxy) propanol 314.3
    mesitylene 142.32
    ε-caprolactone 1024.34
    p-cymene 126.9
    epichlorohydrin 1570.79
    1,1,1-trichloroethane 1151.69
    2-aminoethanol 158.79
    morpholine-4-carbaldehyde 787.42
    sulfolane 1038.78
    2,2,4-trimethylpentane 27.86
    2-methyltetrahydrofuran 729.95
    n-hexyl acetate 479.92
    isooctane 22.82
    2-(2-butoxyethoxy)ethanol 469.39
    sec-butyl acetate 333.47
    tert-butyl acetate 362.32
    decalin 64.24
    glycerin 122.73
    diglyme 927.33
    acrylic acid 401.31
    isopropyl myristate 175.0
    n-butyric acid 786.0
    acetyl acetate 401.29
    di(2-ethylhexyl) phthalate 150.51
    ethyl propionate 437.28
    nitromethane 1132.89
    1,2-diethoxyethane 573.61
    benzonitrile 769.46
    trioctyl phosphate 107.49
    1-bromopropane 861.25
    gamma-valerolactone 1344.86
    n-decanol 125.8
    triethyl phosphate 158.11
    4-methyl-2-pentanol 191.25
    propionitrile 743.82
    vinylene carbonate 785.31
    1,1,2-trichlorotrifluoroethane 735.89
    DMS 371.76
    cumene 169.82
    2-octanol 142.87
    2-hexanone 539.71
    octyl acetate 222.51
    limonene 175.36
    1,2-dimethoxyethane 768.18
    ethyl orthosilicate 142.14
    tributyl phosphate 149.25
    diacetone alcohol 356.45
    N,N-dimethylaniline 292.5
    acrylonitrile 973.33
    aniline 504.24
    1,3-propanediol 297.8
    bromobenzene 1024.51
    dibromomethane 1667.35
    1,1,2,2-tetrachloroethane 2600.01
    2-methyl-cyclohexyl acetate 265.97
    tetrabutyl urea 199.95
    diisobutyl methanol 132.55
    2-phenylethanol 329.7
    styrene 413.46
    dioctyl adipate 256.17
    dimethyl sulfate 317.91
    ethyl butyrate 404.5
    methyl lactate 226.66
    butyl lactate 263.11
    diethyl carbonate 298.8
    propanediol butyl ether 280.55
    triethyl orthoformate 242.66
    p-tert-butyltoluene 113.31
    methyl 4-tert-butylbenzoate 306.53
    morpholine 1089.96
    tert-butylamine 248.93
    n-dodecanol 96.04
    dimethoxymethane 602.78
    ethylene carbonate 639.85
    cyrene 248.5
    2-ethoxyethyl acetate 421.27
    2-ethylhexyl acetate 396.83
    1,2,4-trichlorobenzene 843.84
    4-methylpyridine 1353.78
    dibutyl ether 323.17
    2,6-dimethyl-4-heptanol 132.55
    DEF 910.61
    dimethyl isosorbide 472.43
    tetrachloroethylene 1385.34
    eugenol 311.53
    triacetin 361.21
    span 80 271.34
    1,4-butanediol 100.41
    1,1-dichloroethane 1632.44
    2-methyl-1-pentanol 307.34
    methyl formate 440.52
    2-methyl-1-butanol 457.16
    n-decane 33.95
    butyronitrile 858.43
    3,7-dimethyl-1-octanol 209.26
    1-chlorooctane 183.77
    1-chlorotetradecane 68.57
    n-nonane 31.69
    undecane 26.03
    tert-butylcyclohexane 48.94
    cyclooctane 35.97
    cyclopentanol 444.03
    tetrahydropyran 1092.47
    tert-amyl methyl ether 289.45
    2,5,8-trioxanonane 556.35
    1-hexene 310.26
    2-isopropoxyethanol 236.01
    2,2,2-trifluoroethanol 163.92
    methyl butyrate 690.69

    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

Botanical

Name CAS Botanical Proportion
Jasmine sambac (China) headspace Jasminum sambac (L.) Aiton, fam. Oleaceae 3.37%