Arctiopicrin

Overview IFRA Request a quote

  • Identifiers

    CAS number
    19889-01-1

    Molecular formula
    C19H26O6

    SMILES
    C/C/1=C\CC/C(=C/[C@@H]2[C@@H]([C@H](C1)OC(=O)C(C)CO)C(=C)C(=O)O2)/CO

    Safety labels

  • Odor profile

    Fragrance
    Sweet 37.4%
    Odorless 35.36%
    Caramellic 28.39%
    Mint 26.61%
    Floral 23.52%
    Spicy 23.44%
    Lactonic 23.21%
    Nutty 21.22%
    Herbal 20.05%
    Green 18.24%

     

    Flavor
    Bitter 66.31%
    Odorless 22.09%
    Very mild 20.18%
    Seedy 19.59%
    Sweet-like 19.47%
    Cedarleaf 19.46%
    Leaves 19.37%
    Cotton candy 19.35%
    Extremely sweet 19.24%
    Lovage 19.19%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.0

    pKa est.
    7.34 (neutral)

    Molecular weight
    350.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    875°C

    Flash point

    • 228.39 ˚C est.

  • Synonyms

    • Arctiopicrin
    • 19889-01-1
    • [(3aR,4S,6E,10Z,11aR)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 3-hydroxy-2-methylpropanoate
    • ((3aR,4S,6E,10Z,11aR)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca(b)furan-4-yl) 3-hydroxy-2-methylpropanoate
    • RefChem:113759
    • ((3aR,4S,6E,10Z,11aR)-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca(b)furan-4-yl) 3-hydroxy-2-methyl-propanoate
    • [(3aR,4S,6E,10Z,11aR)-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 3-hydroxy-2-methyl-propanoate
    • 3-Hydroxy-2-methylpropionic acid [(3aR)-2,3,3abeta,4,5,8,9,11aalpha-octahydro-10-hydroxymethyl-6-methyl-3-m
    • MEGxp0_001131
    • CHEBI:2810
    • SCHEMBL29453233
    • ACon1_001572
    • NSC177853
    • C09297
    • Q27105827
    • 19889-01-1

  • Applications

    Arctiopicrin (CAS 19889-01-1) is a natural product that is often considered as a chemical intermediate; practical applications may include use as a fragrance/odorant component in perfumery, as an ingredient in cosmetics and personal care formulations, and as a research reagent or lead in pharmaceutical and agrochemical development; it may also be evaluated as an intermediate in organic synthesis and as a niche additive for coatings or inks under formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 345.51
    methanol 578.1
    isopropanol 235.66
    water 0.71
    ethyl acetate 185.71
    n-propanol 303.54
    acetone 360.28
    n-butanol 261.78
    acetonitrile 106.66
    DMF 734.99
    toluene 49.12
    isobutanol 188.94
    1,4-dioxane 288.3
    methyl acetate 162.16
    THF 623.26
    2-butanone 227.53
    n-pentanol 173.83
    sec-butanol 195.82
    n-hexane 2.16
    ethylene glycol 57.48
    NMP 531.69
    cyclohexane 5.1
    DMSO 722.64
    n-butyl acetate 84.89
    n-octanol 35.9
    chloroform 329.31
    n-propyl acetate 99.64
    acetic acid 767.05
    dichloromethane 271.92
    cyclohexanone 325.29
    propylene glycol 110.1
    isopropyl acetate 111.98
    DMAc 685.68
    2-ethoxyethanol 347.92
    isopentanol 196.82
    n-heptane 1.22
    ethyl formate 132.56
    1,2-dichloroethane 184.59
    n-hexanol 94.84
    2-methoxyethanol 566.84
    isobutyl acetate 63.2
    tetrachloromethane 27.79
    n-pentyl acetate 68.48
    transcutol 664.89
    n-heptanol 51.09
    ethylbenzene 23.74
    MIBK 125.34
    2-propoxyethanol 264.18
    tert-butanol 187.66
    MTBE 78.38
    2-butoxyethanol 156.99
    propionic acid 237.71
    o-xylene 34.65
    formic acid 385.53
    diethyl ether 104.44
    m-xylene 38.21
    p-xylene 30.66
    chlorobenzene 65.22
    dimethyl carbonate 123.26
    n-octane 0.78
    formamide 467.72
    cyclopentanone 383.6
    2-pentanone 218.18
    anisole 82.18
    cyclopentyl methyl ether 179.95
    gamma-butyrolactone 422.08
    1-methoxy-2-propanol 427.6
    pyridine 217.07
    3-pentanone 125.55
    furfural 305.13
    n-dodecane 0.88
    diethylene glycol 225.81
    diisopropyl ether 21.58
    tert-amyl alcohol 156.51
    acetylacetone 234.01
    n-hexadecane 1.03
    acetophenone 112.51
    methyl propionate 183.79
    isopentyl acetate 82.09
    trichloroethylene 399.05
    n-nonanol 37.11
    cyclohexanol 172.37
    benzyl alcohol 129.72
    2-ethylhexanol 39.81
    isooctanol 40.59
    dipropyl ether 27.74
    1,2-dichlorobenzene 62.58
    ethyl lactate 92.84
    propylene carbonate 215.08
    n-methylformamide 378.62
    2-pentanol 140.18
    n-pentane 2.72
    1-propoxy-2-propanol 138.35
    1-methoxy-2-propyl acetate 137.9
    2-(2-methoxypropoxy) propanol 139.21
    mesitylene 20.87
    ε-caprolactone 305.37
    p-cymene 14.24
    epichlorohydrin 458.25
    1,1,1-trichloroethane 116.76
    2-aminoethanol 169.92
    morpholine-4-carbaldehyde 497.47
    sulfolane 476.04
    2,2,4-trimethylpentane 2.68
    2-methyltetrahydrofuran 289.71
    n-hexyl acetate 85.61
    isooctane 1.89
    2-(2-butoxyethoxy)ethanol 211.36
    sec-butyl acetate 67.63
    tert-butyl acetate 107.14
    decalin 3.71
    glycerin 202.23
    diglyme 342.65
    acrylic acid 234.06
    isopropyl myristate 28.16
    n-butyric acid 338.75
    acetyl acetate 119.74
    di(2-ethylhexyl) phthalate 50.23
    ethyl propionate 85.64
    nitromethane 592.7
    1,2-diethoxyethane 103.78
    benzonitrile 88.5
    trioctyl phosphate 35.04
    1-bromopropane 71.2
    gamma-valerolactone 611.8
    n-decanol 24.35
    triethyl phosphate 41.64
    4-methyl-2-pentanol 73.2
    propionitrile 98.32
    vinylene carbonate 203.32
    1,1,2-trichlorotrifluoroethane 400.09
    DMS 90.99
    cumene 16.98
    2-octanol 28.67
    2-hexanone 108.31
    octyl acetate 41.73
    limonene 20.66
    1,2-dimethoxyethane 325.8
    ethyl orthosilicate 38.98
    tributyl phosphate 41.32
    diacetone alcohol 204.78
    N,N-dimethylaniline 62.21
    acrylonitrile 135.82
    aniline 119.51
    1,3-propanediol 303.95
    bromobenzene 52.86
    dibromomethane 148.01
    1,1,2,2-tetrachloroethane 304.75
    2-methyl-cyclohexyl acetate 63.92
    tetrabutyl urea 54.7
    diisobutyl methanol 21.32
    2-phenylethanol 97.13
    styrene 28.7
    dioctyl adipate 56.51
    dimethyl sulfate 205.78
    ethyl butyrate 58.12
    methyl lactate 170.4
    butyl lactate 88.34
    diethyl carbonate 43.68
    propanediol butyl ether 151.02
    triethyl orthoformate 49.34
    p-tert-butyltoluene 13.28
    methyl 4-tert-butylbenzoate 93.87
    morpholine 476.3
    tert-butylamine 59.17
    n-dodecanol 16.16
    dimethoxymethane 419.76
    ethylene carbonate 175.23
    cyrene 180.73
    2-ethoxyethyl acetate 125.83
    2-ethylhexyl acetate 57.36
    1,2,4-trichlorobenzene 94.92
    4-methylpyridine 193.06
    dibutyl ether 25.19
    2,6-dimethyl-4-heptanol 21.32
    DEF 248.53
    dimethyl isosorbide 197.0
    tetrachloroethylene 185.41
    eugenol 104.33
    triacetin 111.36
    span 80 111.6
    1,4-butanediol 120.55
    1,1-dichloroethane 149.93
    2-methyl-1-pentanol 140.11
    methyl formate 249.1
    2-methyl-1-butanol 193.01
    n-decane 1.52
    butyronitrile 100.06
    3,7-dimethyl-1-octanol 38.14
    1-chlorooctane 11.28
    1-chlorotetradecane 4.32
    n-nonane 1.18
    undecane 1.09
    tert-butylcyclohexane 2.63
    cyclooctane 1.87
    cyclopentanol 212.37
    tetrahydropyran 240.35
    tert-amyl methyl ether 71.58
    2,5,8-trioxanonane 230.11
    1-hexene 15.14
    2-isopropoxyethanol 194.51
    2,2,2-trifluoroethanol 211.27
    methyl butyrate 122.12

    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