Sasanquin

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  • Identifiers

    CAS number
    18604-54-1

    Molecular formula
    C21H30O11

    SMILES
    COC1=C(C=CC(=C1)CC=C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 49.04%
    Sweet 45.83%
    Vanilla 34.9%
    Spicy 33.54%
    Woody 21.86%
    Milky 21.03%
    Smoky 20.8%
    Phenolic 20.41%
    Warm 19.86%
    Creamy 19.61%

     

    Flavor
    Bitter 63.66%
    Sweet 39.31%
    Odorless 33.07%
    Sweet-like 28.02%
    Bland 25.33%
    Fatty 21.86%
    Cauliflower 20.89%
    Naphthalic 20.83%
    Very slight 20.57%
    Cedarleaf 20.56%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -1.3

    pKa est.
    6.19 (neutral)

    Molecular weight
    458.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    2987°C

    Flash point

    • 222.3 ˚C est.

  • Synonyms

    • sasanquin
    • eugenol beta-primeveroside
    • eugenyl-GX
    • SCHEMBL30908682
    • eugenyl-p-xylopyranosyl-(1->6)-beta-glucopyranoside
    • eugenyl 6-O-beta-D-xylopyranosyl-1-beta-D-glucopyranoside
    • eugenol O-beta-D-xylopyranosyl-(1->6)-O-beta-D-glucopyranoside
    • 18604-54-1
    • 18604-54-1

  • Applications

    Sasanquin (CAS 18604-54-1) is used as an industrial solvent and processing aid; serves as an organic synthesis intermediate; may function as a stabilizer or plasticizer in plastics and polymers; used as an additive in coatings and inks; may be evaluated for cosmetics and personal care applications as a solvent or fragrance fixative, and may be considered for household and cleaning products as a solvent or processing aid, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 12.28
    methanol 41.6
    isopropanol 5.03
    water 9.8
    ethyl acetate 3.31
    n-propanol 8.4
    acetone 9.84
    n-butanol 8.02
    acetonitrile 3.42
    DMF 61.48
    toluene 1.02
    isobutanol 2.91
    1,4-dioxane 11.37
    methyl acetate 3.39
    THF 20.72
    2-butanone 5.14
    n-pentanol 2.61
    sec-butanol 4.3
    n-hexane 0.06
    ethylene glycol 38.66
    NMP 57.91
    cyclohexane 0.35
    DMSO 296.19
    n-butyl acetate 0.5
    n-octanol 2.54
    chloroform 1.18
    n-propyl acetate 0.7
    acetic acid 70.46
    dichloromethane 1.53
    cyclohexanone 9.87
    propylene glycol 30.72
    isopropyl acetate 1.77
    DMAc 67.66
    2-ethoxyethanol 26.86
    isopentanol 3.32
    n-heptane 0.24
    ethyl formate 4.03
    1,2-dichloroethane 1.71
    n-hexanol 1.54
    2-methoxyethanol 85.07
    isobutyl acetate 0.3
    tetrachloromethane 0.31
    n-pentyl acetate 1.56
    transcutol 49.1
    n-heptanol 2.73
    ethylbenzene 0.31
    MIBK 2.09
    2-propoxyethanol 13.15
    tert-butanol 3.33
    MTBE 1.11
    2-butoxyethanol 11.07
    propionic acid 10.4
    o-xylene 0.88
    formic acid 154.84
    diethyl ether 2.53
    m-xylene 0.68
    p-xylene 0.28
    chlorobenzene 0.39
    dimethyl carbonate 8.36
    n-octane 0.18
    formamide 121.45
    cyclopentanone 15.28
    2-pentanone 5.14
    anisole 1.14
    cyclopentyl methyl ether 6.01
    gamma-butyrolactone 18.04
    1-methoxy-2-propanol 44.57
    pyridine 5.1
    3-pentanone 3.75
    furfural 16.03
    n-dodecane 0.12
    diethylene glycol 31.78
    diisopropyl ether 0.5
    tert-amyl alcohol 3.17
    acetylacetone 10.38
    n-hexadecane 0.13
    acetophenone 1.91
    methyl propionate 6.39
    isopentyl acetate 0.53
    trichloroethylene 2.84
    n-nonanol 2.51
    cyclohexanol 6.33
    benzyl alcohol 3.17
    2-ethylhexanol 0.77
    isooctanol 1.75
    dipropyl ether 1.33
    1,2-dichlorobenzene 0.41
    ethyl lactate 3.85
    propylene carbonate 4.68
    n-methylformamide 33.43
    2-pentanol 3.43
    n-pentane 0.18
    1-propoxy-2-propanol 7.02
    1-methoxy-2-propyl acetate 3.57
    2-(2-methoxypropoxy) propanol 10.5
    mesitylene 0.41
    ε-caprolactone 8.45
    p-cymene 0.33
    epichlorohydrin 12.1
    1,1,1-trichloroethane 0.53
    2-aminoethanol 35.01
    morpholine-4-carbaldehyde 49.39
    sulfolane 57.77
    2,2,4-trimethylpentane 0.08
    2-methyltetrahydrofuran 5.95
    n-hexyl acetate 2.14
    isooctane 0.04
    2-(2-butoxyethoxy)ethanol 16.95
    sec-butyl acetate 0.5
    tert-butyl acetate 1.8
    decalin 0.09
    glycerin 87.71
    diglyme 26.54
    acrylic acid 19.07
    isopropyl myristate 0.78
    n-butyric acid 11.64
    acetyl acetate 3.2
    di(2-ethylhexyl) phthalate 1.63
    ethyl propionate 1.16
    nitromethane 54.11
    1,2-diethoxyethane 3.74
    benzonitrile 1.01
    trioctyl phosphate 1.34
    1-bromopropane 0.68
    gamma-valerolactone 35.26
    n-decanol 1.75
    triethyl phosphate 1.11
    4-methyl-2-pentanol 1.23
    propionitrile 1.75
    vinylene carbonate 4.84
    1,1,2-trichlorotrifluoroethane 30.5
    DMS 2.54
    cumene 0.2
    2-octanol 1.51
    2-hexanone 1.1
    octyl acetate 1.52
    limonene 0.65
    1,2-dimethoxyethane 13.23
    ethyl orthosilicate 1.01
    tributyl phosphate 1.09
    diacetone alcohol 10.5
    N,N-dimethylaniline 1.2
    acrylonitrile 3.59
    aniline 3.09
    1,3-propanediol 43.04
    bromobenzene 0.28
    dibromomethane 0.86
    1,1,2,2-tetrachloroethane 2.82
    2-methyl-cyclohexyl acetate 0.95
    tetrabutyl urea 2.29
    diisobutyl methanol 0.63
    2-phenylethanol 1.86
    styrene 0.31
    dioctyl adipate 2.01
    dimethyl sulfate 21.7
    ethyl butyrate 0.83
    methyl lactate 20.13
    butyl lactate 3.72
    diethyl carbonate 0.64
    propanediol butyl ether 15.81
    triethyl orthoformate 1.23
    p-tert-butyltoluene 0.36
    methyl 4-tert-butylbenzoate 5.17
    morpholine 20.18
    tert-butylamine 0.88
    n-dodecanol 1.19
    dimethoxymethane 31.49
    ethylene carbonate 3.68
    cyrene 16.08
    2-ethoxyethyl acetate 4.07
    2-ethylhexyl acetate 0.39
    1,2,4-trichlorobenzene 0.73
    4-methylpyridine 2.86
    dibutyl ether 1.11
    2,6-dimethyl-4-heptanol 0.63
    DEF 11.97
    dimethyl isosorbide 12.68
    tetrachloroethylene 2.25
    eugenol 5.71
    triacetin 5.59
    span 80 10.05
    1,4-butanediol 11.09
    1,1-dichloroethane 0.68
    2-methyl-1-pentanol 1.52
    methyl formate 22.17
    2-methyl-1-butanol 3.44
    n-decane 0.23
    butyronitrile 1.74
    3,7-dimethyl-1-octanol 1.29
    1-chlorooctane 0.58
    1-chlorotetradecane 0.23
    n-nonane 0.21
    undecane 0.16
    tert-butylcyclohexane 0.05
    cyclooctane 0.21
    cyclopentanol 7.55
    tetrahydropyran 5.77
    tert-amyl methyl ether 1.7
    2,5,8-trioxanonane 21.63
    1-hexene 0.17
    2-isopropoxyethanol 8.73
    2,2,2-trifluoroethanol 26.97
    methyl butyrate 1.49

    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