4-((1R,2R,4R)-born-2-yl)cyclohexanol

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  • Identifiers

    CAS number
    66072-32-0

    Molecular formula
    C16H28O

    SMILES
    CC1(C2CCC1(C(C2)C3CCC(CC3)O)C)C

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Woody 88.64%
    Sweet 66.16%
    Sandalwood 61.87%
    Amber 54.86%
    Balsamic 52.01%
    Dry 50.03%
    Musk 46.26%
    Cedar 44.97%
    Clean 42.85%
    Powdery 36.99%

     

    Flavor
    Woody 50.91%
    Sweet 44.96%
    Earthy 44.43%
    Camphor 38.38%
    Pine 36.86%
    Herbal 35.91%
    Earth 33.36%
    Balsam 33.33%
    Dry 33.18%
    Herb 31.16%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    4.6

    pKa est.
    8.22 (weak base)

    Molecular weight
    236.39 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    350°C

    Flash point

    • 119.01 ˚C est.

  • Synonyms

    • 4-((1R,2R,4R)-Born-2-yl)cyclohexanol
    • 66072-32-0
    • EINECS 266-122-3
    • Cyclohexanol, 4-(1,7,7-trimethylbicyclo(2.2.1)hept-2-yl)-
    • Cyclohexanol, 4-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)-
    • DTXSID10867202
    • 4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)cyclohexan-1-ol
    • SCHEMBL1774430
    • DTXCID50815404
    • LFHQKYSBKVWWOS-UHFFFAOYSA-N
    • NS00004592
    • 266-122-3

  • Applications

    4-((1R,2R,4R)-born-2-yl)cyclohexanol is a chiral terpenoid derivative with practical applications across several sectors: it can serve as a fragrance ingredient and potential fixative in perfumes and personal care products, may function as an aroma component in food formulations, acts as a chiral building block or intermediate in organic synthesis for pharmaceutical and agrochemical applications, and can be used in household products to impart scent.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1917.43
    methanol 1580.69
    isopropanol 2305.42
    water 9.21
    ethyl acetate 2922.03
    n-propanol 2009.61
    acetone 3536.67
    n-butanol 1767.82
    acetonitrile 2550.66
    DMF 3474.23
    toluene 1406.98
    isobutanol 1357.84
    1,4-dioxane 4376.69
    methyl acetate 2526.22
    THF 5897.43
    2-butanone 2382.37
    n-pentanol 517.5
    sec-butanol 1111.52
    n-hexane 151.29
    ethylene glycol 299.28
    NMP 723.01
    cyclohexane 430.68
    DMSO 1361.89
    n-butyl acetate 1363.98
    n-octanol 320.13
    chloroform 3645.69
    n-propyl acetate 1115.79
    acetic acid 715.82
    dichloromethane 2772.51
    cyclohexanone 1909.45
    propylene glycol 481.11
    isopropyl acetate 2185.93
    DMAc 1412.74
    2-ethoxyethanol 1087.14
    isopentanol 1295.45
    n-heptane 119.53
    ethyl formate 1430.2
    1,2-dichloroethane 1945.15
    n-hexanol 865.59
    2-methoxyethanol 2452.83
    isobutyl acetate 797.77
    tetrachloromethane 961.01
    n-pentyl acetate 669.75
    transcutol 3169.11
    n-heptanol 376.74
    ethylbenzene 541.31
    MIBK 1321.65
    2-propoxyethanol 1792.16
    tert-butanol 2300.71
    MTBE 3388.41
    2-butoxyethanol 848.57
    propionic acid 979.49
    o-xylene 701.1
    formic acid 272.24
    diethyl ether 3260.41
    m-xylene 940.76
    p-xylene 763.79
    chlorobenzene 1234.64
    dimethyl carbonate 1020.69
    n-octane 54.99
    formamide 862.93
    cyclopentanone 2725.98
    2-pentanone 2092.1
    anisole 1246.58
    cyclopentyl methyl ether 1780.76
    gamma-butyrolactone 2775.39
    1-methoxy-2-propanol 2166.28
    pyridine 2370.56
    3-pentanone 1427.3
    furfural 1791.04
    n-dodecane 32.91
    diethylene glycol 1071.61
    diisopropyl ether 946.69
    tert-amyl alcohol 1054.15
    acetylacetone 2399.64
    n-hexadecane 40.16
    acetophenone 788.19
    methyl propionate 1846.78
    isopentyl acetate 1238.86
    trichloroethylene 2840.39
    n-nonanol 301.54
    cyclohexanol 948.25
    benzyl alcohol 639.87
    2-ethylhexanol 412.66
    isooctanol 330.43
    dipropyl ether 1060.52
    1,2-dichlorobenzene 976.7
    ethyl lactate 459.8
    propylene carbonate 1418.33
    n-methylformamide 2015.38
    2-pentanol 1033.69
    n-pentane 277.88
    1-propoxy-2-propanol 1304.6
    1-methoxy-2-propyl acetate 1696.53
    2-(2-methoxypropoxy) propanol 692.97
    mesitylene 644.4
    ε-caprolactone 1531.91
    p-cymene 329.29
    epichlorohydrin 2850.79
    1,1,1-trichloroethane 2278.35
    2-aminoethanol 755.05
    morpholine-4-carbaldehyde 1605.88
    sulfolane 1513.03
    2,2,4-trimethylpentane 109.94
    2-methyltetrahydrofuran 2522.36
    n-hexyl acetate 772.07
    isooctane 139.29
    2-(2-butoxyethoxy)ethanol 985.71
    sec-butyl acetate 880.34
    tert-butyl acetate 2021.84
    decalin 130.77
    glycerin 560.62
    diglyme 2095.36
    acrylic acid 685.62
    isopropyl myristate 341.81
    n-butyric acid 1622.89
    acetyl acetate 1595.17
    di(2-ethylhexyl) phthalate 256.22
    ethyl propionate 1124.03
    nitromethane 2333.96
    1,2-diethoxyethane 1618.41
    benzonitrile 967.91
    trioctyl phosphate 202.76
    1-bromopropane 1350.37
    gamma-valerolactone 3080.16
    n-decanol 222.1
    triethyl phosphate 360.28
    4-methyl-2-pentanol 710.75
    propionitrile 2421.41
    vinylene carbonate 1469.05
    1,1,2-trichlorotrifluoroethane 1236.71
    DMS 845.4
    cumene 359.45
    2-octanol 262.24
    2-hexanone 804.61
    octyl acetate 378.52
    limonene 371.98
    1,2-dimethoxyethane 2437.56
    ethyl orthosilicate 376.04
    tributyl phosphate 261.19
    diacetone alcohol 1267.31
    N,N-dimethylaniline 633.96
    acrylonitrile 2200.94
    aniline 1403.19
    1,3-propanediol 1449.96
    bromobenzene 1304.72
    dibromomethane 1783.54
    1,1,2,2-tetrachloroethane 2254.13
    2-methyl-cyclohexyl acetate 555.28
    tetrabutyl urea 276.2
    diisobutyl methanol 381.21
    2-phenylethanol 768.09
    styrene 650.9
    dioctyl adipate 401.51
    dimethyl sulfate 899.72
    ethyl butyrate 998.64
    methyl lactate 718.75
    butyl lactate 537.51
    diethyl carbonate 691.68
    propanediol butyl ether 641.55
    triethyl orthoformate 677.37
    p-tert-butyltoluene 375.93
    methyl 4-tert-butylbenzoate 713.26
    morpholine 3832.81
    tert-butylamine 1750.5
    n-dodecanol 167.99
    dimethoxymethane 3164.6
    ethylene carbonate 1488.04
    cyrene 452.44
    2-ethoxyethyl acetate 1112.21
    2-ethylhexyl acetate 822.96
    1,2,4-trichlorobenzene 994.6
    4-methylpyridine 2061.12
    dibutyl ether 630.17
    2,6-dimethyl-4-heptanol 381.21
    DEF 1255.45
    dimethyl isosorbide 1107.84
    tetrachloroethylene 1510.41
    eugenol 606.04
    triacetin 825.49
    span 80 508.44
    1,4-butanediol 343.22
    1,1-dichloroethane 2521.11
    2-methyl-1-pentanol 414.68
    methyl formate 1436.58
    2-methyl-1-butanol 927.54
    n-decane 65.36
    butyronitrile 2108.39
    3,7-dimethyl-1-octanol 395.68
    1-chlorooctane 246.44
    1-chlorotetradecane 92.42
    n-nonane 64.12
    undecane 44.4
    tert-butylcyclohexane 124.32
    cyclooctane 159.35
    cyclopentanol 1065.03
    tetrahydropyran 3702.02
    tert-amyl methyl ether 1174.52
    2,5,8-trioxanonane 1149.8
    1-hexene 415.51
    2-isopropoxyethanol 755.95
    2,2,2-trifluoroethanol 532.16
    methyl butyrate 1266.75

    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