Madlongiside D

Overview IFRA Request a quote

  • Identifiers

    CAS number
    58019-21-9

    Molecular formula
    C41H66O14

    SMILES
    C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2OC(=O)[C@@]34CC[C@@]5(C(=CC[C@H]6[C@]5(C[C@H]([C@@H]7[C@@]6(C[C@@H]([C@@H]([C@@]7(C)CO)O)O)C)O)C)[C@@H]3CC(CC4)(C)C)C)O)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 53.51%
    Woody 44.72%
    Spicy 34.18%
    Sweet 29.7%
    Balsamic 26.66%
    Amber 26.19%
    Cooling 25.76%
    Dry 24.13%
    Mint 22.96%
    Warm 22.08%

     

    Flavor
    Bitter 65.02%
    Fatty 29.54%
    Odorless 27.97%
    Sweet 26.55%
    Sweet-like 26.5%
    Bland 23.35%
    Cedarleaf 22.66%
    Patchouli 21.61%
    Soil 21.14%
    Beet 20.95%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.7

    pKa est.
    4.36 (weak acid)

    Molecular weight
    783.0 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    1623°C

    Flash point

    • 268.65 ˚C est.

  • Synonyms

    • Madlongiside D
    • CHEMBL508213
    • CHEBI:185911
    • DTXSID901022133
    • 58019-21-9
    • [(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl] (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-8,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
    • 58019-21-9

  • Applications

    Madlongiside D (CAS 58019-21-9) is viewed as a candidate for applications in fragrance and as an intermediate in industrial chemical synthesis; in practice, it may be used as a fragrance ingredient in perfumery and cosmetics and personal care, and may be evaluated as a solvent or intermediate in industrial manufacturing, while serving as a fragrance additive in cleaning and household products. In coatings and inks, it may function as an odorant or scenting agent, and in the polymers/plastics sector it could be considered as a processing aid or odor-related additive in certain plastic products. All uses are subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2.98
    methanol 33.59
    isopropanol 0.69
    water 0.06
    ethyl acetate 1.3
    n-propanol 1.5
    acetone 3.05
    n-butanol 0.62
    acetonitrile 0.88
    DMF 35.16
    toluene 0.48
    isobutanol 0.5
    1,4-dioxane 8.87
    methyl acetate 1.7
    THF 16.72
    2-butanone 1.95
    n-pentanol 0.5
    sec-butanol 0.42
    n-hexane 0.02
    ethylene glycol 5.63
    NMP 34.13
    cyclohexane 0.04
    DMSO 32.95
    n-butyl acetate 0.6
    n-octanol 0.57
    chloroform 2.93
    n-propyl acetate 0.61
    acetic acid 22.09
    dichloromethane 2.63
    cyclohexanone 2.96
    propylene glycol 4.61
    isopropyl acetate 0.76
    DMAc 22.34
    2-ethoxyethanol 7.86
    isopentanol 0.35
    n-heptane 0.03
    ethyl formate 1.91
    1,2-dichloroethane 1.24
    n-hexanol 0.47
    2-methoxyethanol 22.79
    isobutyl acetate 0.34
    tetrachloromethane 0.33
    n-pentyl acetate 1.26
    transcutol 12.27
    n-heptanol 0.78
    ethylbenzene 0.17
    MIBK 0.67
    2-propoxyethanol 9.11
    tert-butanol 0.47
    MTBE 0.38
    2-butoxyethanol 5.7
    propionic acid 2.87
    o-xylene 0.3
    formic acid 35.18
    diethyl ether 0.74
    m-xylene 0.31
    p-xylene 0.18
    chlorobenzene 0.48
    dimethyl carbonate 4.16
    n-octane 0.02
    formamide 22.32
    cyclopentanone 8.14
    2-pentanone 1.28
    anisole 0.9
    cyclopentyl methyl ether 2.08
    gamma-butyrolactone 11.59
    1-methoxy-2-propanol 9.06
    pyridine 4.59
    3-pentanone 1.09
    furfural 13.08
    n-dodecane 0.01
    diethylene glycol 13.45
    diisopropyl ether 0.12
    tert-amyl alcohol 0.37
    acetylacetone 4.02
    n-hexadecane 0.01
    acetophenone 1.37
    methyl propionate 2.35
    isopentyl acetate 0.53
    trichloroethylene 4.06
    n-nonanol 0.57
    cyclohexanol 0.48
    benzyl alcohol 1.5
    2-ethylhexanol 0.21
    isooctanol 0.47
    dipropyl ether 0.49
    1,2-dichlorobenzene 0.51
    ethyl lactate 1.49
    propylene carbonate 3.5
    n-methylformamide 17.21
    2-pentanol 0.25
    n-pentane 0.02
    1-propoxy-2-propanol 3.59
    1-methoxy-2-propyl acetate 3.12
    2-(2-methoxypropoxy) propanol 3.59
    mesitylene 0.16
    ε-caprolactone 3.41
    p-cymene 0.14
    epichlorohydrin 10.52
    1,1,1-trichloroethane 0.54
    2-aminoethanol 6.91
    morpholine-4-carbaldehyde 37.89
    sulfolane 25.87
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 2.22
    n-hexyl acetate 1.27
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 5.55
    sec-butyl acetate 0.32
    tert-butyl acetate 0.88
    decalin 0.02
    glycerin 15.84
    diglyme 11.64
    acrylic acid 6.62
    isopropyl myristate 0.26
    n-butyric acid 2.27
    acetyl acetate 1.6
    di(2-ethylhexyl) phthalate 0.74
    ethyl propionate 0.65
    nitromethane 23.14
    1,2-diethoxyethane 1.64
    benzonitrile 0.76
    trioctyl phosphate 0.45
    1-bromopropane 0.3
    gamma-valerolactone 28.3
    n-decanol 0.29
    triethyl phosphate 0.45
    4-methyl-2-pentanol 0.18
    propionitrile 0.58
    vinylene carbonate 4.45
    1,1,2-trichlorotrifluoroethane 21.71
    DMS 1.84
    cumene 0.11
    2-octanol 0.32
    2-hexanone 0.65
    octyl acetate 0.53
    limonene 0.17
    1,2-dimethoxyethane 7.64
    ethyl orthosilicate 0.41
    tributyl phosphate 0.35
    diacetone alcohol 2.57
    N,N-dimethylaniline 0.79
    acrylonitrile 1.62
    aniline 1.0
    1,3-propanediol 4.84
    bromobenzene 0.39
    dibromomethane 1.02
    1,1,2,2-tetrachloroethane 2.86
    2-methyl-cyclohexyl acetate 0.59
    tetrabutyl urea 0.69
    diisobutyl methanol 0.13
    2-phenylethanol 1.4
    styrene 0.19
    dioctyl adipate 0.69
    dimethyl sulfate 9.6
    ethyl butyrate 0.54
    methyl lactate 6.12
    butyl lactate 1.98
    diethyl carbonate 0.37
    propanediol butyl ether 6.23
    triethyl orthoformate 0.66
    p-tert-butyltoluene 0.15
    methyl 4-tert-butylbenzoate 2.68
    morpholine 9.84
    tert-butylamine 0.13
    n-dodecanol 0.15
    dimethoxymethane 18.05
    ethylene carbonate 2.57
    cyrene 8.24
    2-ethoxyethyl acetate 3.71
    2-ethylhexyl acetate 0.38
    1,2,4-trichlorobenzene 0.91
    4-methylpyridine 1.91
    dibutyl ether 0.24
    2,6-dimethyl-4-heptanol 0.13
    DEF 3.18
    dimethyl isosorbide 6.96
    tetrachloroethylene 2.4
    eugenol 3.04
    triacetin 3.15
    span 80 3.56
    1,4-butanediol 1.77
    1,1-dichloroethane 0.55
    2-methyl-1-pentanol 0.29
    methyl formate 14.11
    2-methyl-1-butanol 0.36
    n-decane 0.03
    butyronitrile 0.4
    3,7-dimethyl-1-octanol 0.28
    1-chlorooctane 0.14
    1-chlorotetradecane 0.04
    n-nonane 0.02
    undecane 0.02
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 1.08
    tetrahydropyran 1.83
    tert-amyl methyl ether 0.39
    2,5,8-trioxanonane 6.77
    1-hexene 0.07
    2-isopropoxyethanol 2.8
    2,2,2-trifluoroethanol 7.0
    methyl butyrate 0.86

    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