Cinnzeylanin

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  • Identifiers

    CAS number
    62203-47-8

    Molecular formula
    C22H34O8

    SMILES
    C[C@H]1CC[C@@]2([C@@]3(C[C@]4([C@]5([C@](C[C@@]3([C@]5([C@]2([C@@H]1OC(=O)C)O4)O)O)(C(C)C)O)C)O)C)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 50.18%
    Woody 43.24%
    Sweet 31.17%
    Cooling 30.9%
    Mint 26.62%
    Balsamic 25.89%
    Camphoreous 25.28%
    Spicy 24.6%
    Earthy 23.08%
    Dry 22.29%

     

    Flavor
    Bitter 69.99%
    Sweet 28.71%
    Odorless 27.29%
    Sweet-like 25.51%
    Fatty 24.97%
    Cedarleaf 22.04%
    Fir 21.5%
    Patchouli 21.48%
    Bland 20.75%
    Ripe apricot 20.74%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -0.3

    pKa est.
    9.03 (weak base)

    Molecular weight
    426.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    108°C

    Flash point

    • 202.63 ˚C est.

  • Synonyms

    • Cinnzeylanine
    • Cinnzeylanin
    • 6,9-Methanobenzo[1,2]pentaleno[1,6-bc]furan-4,6,7,8a,8b,9a(6aH,9H)-hexol, hexahydro-3,6a,9-trimethyl-7-(1-methylethyl)-, 1-acetate, (3S,4R,4aR,6S,6aS,7S,8aR,8bR,9R,9aS)-
    • 62203-47-8
    • 3-Deoxyryanodol 10-acetate
    • Ryanodol, 3-deoxy-, 10-acetate
    • 549JG6VN27
    • DTXSID801099183
    • 6,9-Methanobenzo[1,2]pentaleno[1,6-bc]furan-4,6,7,8a,8b,9a(6aH,9H)-hexol, hexahydro-3,6a,9-trimethyl-7-(1-methylethyl)-, 4-acetate, [3S-(3alpha,4beta,4aS*,6alpha,6aalpha,7alpha,8aalpha,8balpha,9beta,9aalpha)]-
    • 62203-47-8

  • Applications

    Cinnzeylanin (CAS 62203-47-8) is a natural aroma constituent associated with cinnamon essential oils and related extracts. In perfumery and fragrance applications, it is commonly evaluated as an odorant and may function as a fragrance ingredient or a fixative in cosmetic and consumer-product formulations. In the flavor industry, it may be used as a cinnamon-like flavor note in specific formulations. In cosmetics and personal care, it appears as part of fragrance formulations for soaps, lotions, and deodorants. In household products and cleaners, it can contribute a cinnamon-scented profile to air fresheners, detergents, and cleaning agents. In coatings, inks, and certain polymer formulations, it may be used as an odorant additive to impart aroma, with actual use limited by regulatory and formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 38.78
    methanol 106.77
    isopropanol 35.38
    water 1.62
    ethyl acetate 43.35
    n-propanol 39.99
    acetone 85.73
    n-butanol 37.62
    acetonitrile 28.7
    DMF 268.69
    toluene 12.73
    isobutanol 25.76
    1,4-dioxane 107.7
    methyl acetate 44.79
    THF 214.24
    2-butanone 61.99
    n-pentanol 25.25
    sec-butanol 22.65
    n-hexane 0.71
    ethylene glycol 33.98
    NMP 235.26
    cyclohexane 1.63
    DMSO 327.29
    n-butyl acetate 36.84
    n-octanol 8.89
    chloroform 69.1
    n-propyl acetate 29.72
    acetic acid 86.2
    dichloromethane 57.34
    cyclohexanone 115.92
    propylene glycol 31.01
    isopropyl acetate 30.87
    DMAc 166.01
    2-ethoxyethanol 70.77
    isopentanol 24.57
    n-heptane 0.6
    ethyl formate 49.31
    1,2-dichloroethane 43.2
    n-hexanol 26.67
    2-methoxyethanol 152.8
    isobutyl acetate 18.45
    tetrachloromethane 13.45
    n-pentyl acetate 28.34
    transcutol 32.02
    n-heptanol 17.04
    ethylbenzene 6.65
    MIBK 28.34
    2-propoxyethanol 108.75
    tert-butanol 27.95
    MTBE 10.12
    2-butoxyethanol 51.59
    propionic acid 45.36
    o-xylene 8.24
    formic acid 89.01
    diethyl ether 20.07
    m-xylene 8.55
    p-xylene 8.86
    chlorobenzene 22.61
    dimethyl carbonate 56.43
    n-octane 0.34
    formamide 117.03
    cyclopentanone 196.56
    2-pentanone 53.53
    anisole 17.58
    cyclopentyl methyl ether 44.93
    gamma-butyrolactone 203.34
    1-methoxy-2-propanol 107.67
    pyridine 72.95
    3-pentanone 40.0
    furfural 144.42
    n-dodecane 0.28
    diethylene glycol 109.44
    diisopropyl ether 4.63
    tert-amyl alcohol 16.93
    acetylacetone 76.5
    n-hexadecane 0.34
    acetophenone 33.06
    methyl propionate 54.48
    isopentyl acetate 28.32
    trichloroethylene 89.08
    n-nonanol 9.7
    cyclohexanol 30.59
    benzyl alcohol 30.23
    2-ethylhexanol 11.85
    isooctanol 11.93
    dipropyl ether 11.04
    1,2-dichlorobenzene 23.19
    ethyl lactate 31.17
    propylene carbonate 87.57
    n-methylformamide 143.57
    2-pentanol 17.0
    n-pentane 0.88
    1-propoxy-2-propanol 50.86
    1-methoxy-2-propyl acetate 56.97
    2-(2-methoxypropoxy) propanol 27.45
    mesitylene 5.02
    ε-caprolactone 93.43
    p-cymene 5.64
    epichlorohydrin 162.07
    1,1,1-trichloroethane 28.95
    2-aminoethanol 46.4
    morpholine-4-carbaldehyde 214.69
    sulfolane 287.63
    2,2,4-trimethylpentane 0.48
    2-methyltetrahydrofuran 64.83
    n-hexyl acetate 25.36
    isooctane 0.39
    2-(2-butoxyethoxy)ethanol 32.23
    sec-butyl acetate 17.99
    tert-butyl acetate 25.4
    decalin 1.0
    glycerin 81.9
    diglyme 62.23
    acrylic acid 58.51
    isopropyl myristate 8.79
    n-butyric acid 62.86
    acetyl acetate 42.74
    di(2-ethylhexyl) phthalate 16.85
    ethyl propionate 28.22
    nitromethane 168.38
    1,2-diethoxyethane 17.02
    benzonitrile 30.81
    trioctyl phosphate 14.45
    1-bromopropane 16.3
    gamma-valerolactone 252.02
    n-decanol 6.44
    triethyl phosphate 16.13
    4-methyl-2-pentanol 10.21
    propionitrile 28.62
    vinylene carbonate 89.42
    1,1,2-trichlorotrifluoroethane 135.98
    DMS 36.87
    cumene 4.53
    2-octanol 8.62
    2-hexanone 33.92
    octyl acetate 14.1
    limonene 7.24
    1,2-dimethoxyethane 89.99
    ethyl orthosilicate 12.8
    tributyl phosphate 13.39
    diacetone alcohol 44.28
    N,N-dimethylaniline 13.77
    acrylonitrile 49.36
    aniline 25.29
    1,3-propanediol 71.41
    bromobenzene 19.06
    dibromomethane 33.72
    1,1,2,2-tetrachloroethane 69.13
    2-methyl-cyclohexyl acetate 22.92
    tetrabutyl urea 20.89
    diisobutyl methanol 5.87
    2-phenylethanol 37.13
    styrene 7.01
    dioctyl adipate 15.79
    dimethyl sulfate 113.66
    ethyl butyrate 23.41
    methyl lactate 68.96
    butyl lactate 27.53
    diethyl carbonate 17.29
    propanediol butyl ether 29.55
    triethyl orthoformate 17.83
    p-tert-butyltoluene 5.1
    methyl 4-tert-butylbenzoate 31.03
    morpholine 116.16
    tert-butylamine 8.44
    n-dodecanol 4.12
    dimethoxymethane 154.13
    ethylene carbonate 77.16
    cyrene 66.8
    2-ethoxyethyl acetate 40.52
    2-ethylhexyl acetate 23.41
    1,2,4-trichlorobenzene 31.57
    4-methylpyridine 55.1
    dibutyl ether 5.13
    2,6-dimethyl-4-heptanol 5.87
    DEF 72.23
    dimethyl isosorbide 60.57
    tetrachloroethylene 53.7
    eugenol 33.17
    triacetin 31.05
    span 80 27.81
    1,4-butanediol 32.43
    1,1-dichloroethane 28.62
    2-methyl-1-pentanol 16.98
    methyl formate 122.83
    2-methyl-1-butanol 22.26
    n-decane 0.55
    butyronitrile 27.58
    3,7-dimethyl-1-octanol 7.71
    1-chlorooctane 3.67
    1-chlorotetradecane 1.37
    n-nonane 0.42
    undecane 0.37
    tert-butylcyclohexane 0.71
    cyclooctane 0.61
    cyclopentanol 53.65
    tetrahydropyran 53.27
    tert-amyl methyl ether 10.06
    2,5,8-trioxanonane 41.22
    1-hexene 3.41
    2-isopropoxyethanol 37.21
    2,2,2-trifluoroethanol 61.52
    methyl butyrate 38.94

    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