Lanierone

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    28750-52-9

    Molecular formula
    C9H12O2

    SMILES
    CC1=CC(C=C(C1=O)O)(C)C

  • Odor profile

    Sweet 78.05%
    Woody 47.35%
    Caramellic 47.29%
    Mint 44.81%
    Spicy 42.05%
    Tobacco 39.09%
    Herbal 36.07%
    Phenolic 35.04%
    Burnt 32.06%
    Hay 31.77%

    Scent© AI

  • Properties

    XLogP3-AA
    2.2

    Molecular weight
    152.19 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    237°C

    Flash point est.
    108.69 ˚C

  • Synonyms

    • Lanierone
    • 2-hydroxy-4,4,6-trimethylcyclohexa-2,5-dien-1-one
    • SCHEMBL1301789
    • GKOBUKITZSFCJC-UHFFFAOYSA-N
    • DTXSID201031959
    • 28750-52-9
    • 2-Hydroxy-4,4,6-trimethyl-2,5-cyclohexadienone
    • 2-Hydroxy-4,4,6-trimethylcyclohexa-2,5-dienone
    • 2-hydroxy-4,4,6-trimethyl-2,5-cyclohexadien-1-one
    • 4,4,6-Trimethyl-2-hydroxycyclohexa-2,5-diene-1-one
    • Q19597672
    • 2,5-Cyclohexadien-1-one, 2-hydroxy-4,4,6-trimethyl-
    • InChI=1/C9H12O2/c1-6-4-9(2,3)5-7(10)8(6)11/h4-5,10H,1-3H

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 355.58
    methanol 505.62
    isopropanol 232.11
    water 2.3
    ethyl acetate 232.39
    n-propanol 247.39
    acetone 279.1
    n-butanol 213.05
    acetonitrile 279.7
    DMF 356.07
    toluene 107.97
    isobutanol 151.78
    1,4-dioxane 451.39
    methyl acetate 208.76
    THF 808.65
    2-butanone 209.61
    n-pentanol 139.74
    sec-butanol 161.06
    n-hexane 37.14
    ethylene glycol 87.53
    NMP 310.71
    cyclohexane 32.05
    DMSO 260.14
    n-butyl acetate 162.0
    n-octanol 108.61
    chloroform 317.83
    n-propyl acetate 116.61
    acetic acid 247.21
    dichloromethane 289.56
    cyclohexanone 257.27
    propylene glycol 84.37
    isopropyl acetate 137.5
    DMAc 155.63
    2-ethoxyethanol 188.55
    isopentanol 147.4
    n-heptane 31.04
    ethyl formate 167.68
    1,2-dichloroethane 207.64
    n-hexanol 260.27
    2-methoxyethanol 364.86
    isobutyl acetate 76.8
    tetrachloromethane 61.84
    n-pentyl acetate 96.79
    transcutol 414.5
    n-heptanol 107.6
    ethylbenzene 60.52
    MIBK 140.46
    2-propoxyethanol 337.26
    tert-butanol 244.7
    MTBE 173.85
    2-butoxyethanol 152.58
    propionic acid 165.5
    o-xylene 68.71
    formic acid 166.95
    diethyl ether 281.28
    m-xylene 102.39
    p-xylene 67.65
    chlorobenzene 122.38
    dimethyl carbonate 92.34
    n-octane 13.47
    formamide 162.02
    cyclopentanone 381.88
    2-pentanone 213.69
    anisole 122.54
    cyclopentyl methyl ether 292.47
    gamma-butyrolactone 456.23
    1-methoxy-2-propanol 276.49
    pyridine 201.88
    3-pentanone 137.93
    furfural 275.91
    n-dodecane 11.14
    diethylene glycol 248.36
    diisopropyl ether 87.31
    tert-amyl alcohol 159.03
    acetylacetone 192.5
    n-hexadecane 12.5
    acetophenone 95.97
    methyl propionate 180.35
    isopentyl acetate 134.65
    trichloroethylene 325.06
    n-nonanol 89.34
    cyclohexanol 156.6
    benzyl alcohol 92.59
    2-ethylhexanol 113.04
    isooctanol 78.09
    dipropyl ether 127.78
    1,2-dichlorobenzene 106.64
    ethyl lactate 70.73
    propylene carbonate 205.88
    n-methylformamide 245.52
    2-pentanol 144.44
    n-pentane 39.18
    1-propoxy-2-propanol 207.2
    1-methoxy-2-propyl acetate 170.02
    2-(2-methoxypropoxy) propanol 118.09
    mesitylene 67.32
    ε-caprolactone 229.16
    p-cymene 48.65
    epichlorohydrin 408.37
    1,1,1-trichloroethane 186.88
    2-aminoethanol 140.45
    morpholine-4-carbaldehyde 275.36
    sulfolane 367.96
    2,2,4-trimethylpentane 19.62
    2-methyltetrahydrofuran 391.75
    n-hexyl acetate 149.36
    isooctane 22.75
    2-(2-butoxyethoxy)ethanol 173.53
    sec-butyl acetate 83.24
    tert-butyl acetate 159.74
    decalin 21.22
    glycerin 115.77
    diglyme 263.38
    acrylic acid 149.68
    isopropyl myristate 62.07
    n-butyric acid 212.06
    acetyl acetate 123.43
    di(2-ethylhexyl) phthalate 55.62
    ethyl propionate 113.59
    nitromethane 347.83
    1,2-diethoxyethane 151.09
    benzonitrile 120.98
    trioctyl phosphate 50.42
    1-bromopropane 155.49
    gamma-valerolactone 375.74
    n-decanol 66.86
    triethyl phosphate 53.07
    4-methyl-2-pentanol 95.84
    propionitrile 192.99
    vinylene carbonate 175.99
    1,1,2-trichlorotrifluoroethane 181.86
    DMS 110.97
    cumene 47.13
    2-octanol 75.5
    2-hexanone 121.78
    octyl acetate 78.26
    limonene 66.79
    1,2-dimethoxyethane 268.62
    ethyl orthosilicate 55.87
    tributyl phosphate 56.01
    diacetone alcohol 181.22
    N,N-dimethylaniline 82.15
    acrylonitrile 207.65
    aniline 118.11
    1,3-propanediol 198.1
    bromobenzene 114.84
    dibromomethane 211.7
    1,1,2,2-tetrachloroethane 224.26
    2-methyl-cyclohexyl acetate 85.95
    tetrabutyl urea 66.82
    diisobutyl methanol 70.59
    2-phenylethanol 126.19
    styrene 66.49
    dioctyl adipate 71.95
    dimethyl sulfate 122.85
    ethyl butyrate 102.81
    methyl lactate 97.12
    butyl lactate 82.17
    diethyl carbonate 68.18
    propanediol butyl ether 136.76
    triethyl orthoformate 72.11
    p-tert-butyltoluene 53.22
    methyl 4-tert-butylbenzoate 111.73
    morpholine 448.13
    tert-butylamine 154.61
    n-dodecanol 51.18
    dimethoxymethane 318.35
    ethylene carbonate 152.69
    cyrene 109.14
    2-ethoxyethyl acetate 124.86
    2-ethylhexyl acetate 102.62
    1,2,4-trichlorobenzene 115.32
    4-methylpyridine 197.85
    dibutyl ether 84.74
    2,6-dimethyl-4-heptanol 70.59
    DEF 169.35
    dimethyl isosorbide 201.01
    tetrachloroethylene 157.68
    eugenol 111.11
    triacetin 95.76
    span 80 103.24
    1,4-butanediol 76.58
    1,1-dichloroethane 209.24
    2-methyl-1-pentanol 103.44
    methyl formate 219.88
    2-methyl-1-butanol 133.01
    n-decane 18.81
    butyronitrile 209.42
    3,7-dimethyl-1-octanol 90.28
    1-chlorooctane 66.56
    1-chlorotetradecane 27.74
    n-nonane 19.1
    undecane 14.02
    tert-butylcyclohexane 23.52
    cyclooctane 16.77
    cyclopentanol 195.84
    tetrahydropyran 386.57
    tert-amyl methyl ether 137.17
    2,5,8-trioxanonane 170.75
    1-hexene 94.23
    2-isopropoxyethanol 130.35
    2,2,2-trifluoroethanol 100.1
    methyl butyrate 130.57

    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
Saffron 2 8022-19-3 Crocus sativus L., fam. Iridaceae 3.58%