Mangiferonic Acid

  • Identifiers

    CAS number
    13878-90-5

    Molecular formula
    C30H46O3

    SMILES
    C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CCC(=O)C5(C)C)C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 87.37%
    Amber 55.83%
    Sandalwood 50.79%
    Dry 47.31%
    Cedar 44.88%
    Musk 40.13%
    Vetiver 39.87%
    Powdery 35.35%
    Balsamic 33.32%
    Animal 31.56%

     

    Flavor
    Woody 61.72%
    Balsam 28.37%
    Herbal 27.68%
    Wood 26.02%
    Camphor 25.01%
    Sandalwood 22.0%
    Pine 21.82%
    Fir needle 21.66%
    Balsamic 20.03%
    Ripe apricot 19.88%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    8.2

    pKa est.
    7.17 (neutral)

    Molecular weight
    454.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    475°C

    Flash point

    • 204.11 ˚C est.

  • Synonyms

    • Mangiferonic acid
    • 13878-90-5
    • (24E)-3-Oxo-9,19-cyclolanost-24-en-26-oic acid
    • 9,19-Cyclolanost-24-en-26-oic acid, 3-oxo-, (24E)-
    • (E,6R)-2-methyl-6-[(1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]hept-2-enoic acid
    • Mangiferonate
    • (E,6R)-2-methyl-6-((1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo(9.7.0.01,3.03,8.012,16)octadecanyl)hept-2-enoic acid
    • RefChem:155620
    • 3-Oxo-(24E)-9,19-Cyclolanost-24-en-26-oic acid
    • CHEMBL490331
    • SCHEMBL30415919
    • CHEBI:172009
    • DTXSID901316348
    • (24E)-3-Oxo-9beta,19-cyclo-5alpha-lanost-24-en-26-oic acid
    • (24E)-3-Oxo-9beta-9,19-cyclolanost-24-en-26-oic acid
    • 13878-90-5
  • Applications

    Mangiferonic Acid (CAS 13878-90-5) may serve as an intermediate in organic synthesis and potentially act as an antioxidant/stabilizer in polymers and coatings; in cosmetics and personal care it could function as an antioxidant ingredient; in pharmaceutical development it may be used as a synthesis building block for active compounds; and in industrial manufacturing it may be considered as an additive for plastics, inks, or adhesives, with actual use governed by local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 5.38
    methanol 3.06
    isopropanol 5.24
    water 0.01
    ethyl acetate 3.48
    n-propanol 6.25
    acetone 4.09
    n-butanol 5.72
    acetonitrile 1.44
    DMF 8.96
    toluene 3.38
    isobutanol 4.01
    1,4-dioxane 7.83
    methyl acetate 2.8
    THF 12.45
    2-butanone 5.43
    n-pentanol 3.64
    sec-butanol 3.23
    n-hexane 0.16
    ethylene glycol 0.68
    NMP 8.24
    cyclohexane 0.2
    DMSO 3.75
    n-butyl acetate 3.68
    n-octanol 1.6
    chloroform 9.49
    n-propyl acetate 2.6
    acetic acid 3.59
    dichloromethane 5.03
    cyclohexanone 7.42
    propylene glycol 1.41
    isopropyl acetate 4.4
    DMAc 12.46
    2-ethoxyethanol 7.97
    isopentanol 4.54
    n-heptane 0.13
    ethyl formate 1.64
    1,2-dichloroethane 3.14
    n-hexanol 4.39
    2-methoxyethanol 10.48
    isobutyl acetate 2.88
    tetrachloromethane 1.76
    n-pentyl acetate 4.84
    transcutol 16.05
    n-heptanol 3.32
    ethylbenzene 1.63
    MIBK 4.77
    2-propoxyethanol 18.49
    tert-butanol 4.0
    MTBE 3.59
    2-butoxyethanol 11.47
    propionic acid 3.06
    o-xylene 1.89
    formic acid 1.43
    diethyl ether 3.77
    m-xylene 2.43
    p-xylene 1.76
    chlorobenzene 3.01
    dimethyl carbonate 2.92
    n-octane 0.06
    formamide 2.14
    cyclopentanone 7.69
    2-pentanone 4.99
    anisole 4.47
    cyclopentyl methyl ether 4.58
    gamma-butyrolactone 6.3
    1-methoxy-2-propanol 13.07
    pyridine 7.63
    3-pentanone 4.14
    furfural 6.25
    n-dodecane 0.03
    diethylene glycol 8.42
    diisopropyl ether 1.37
    tert-amyl alcohol 2.91
    acetylacetone 5.92
    n-hexadecane 0.04
    acetophenone 4.13
    methyl propionate 4.07
    isopentyl acetate 5.04
    trichloroethylene 7.63
    n-nonanol 2.0
    cyclohexanol 2.99
    benzyl alcohol 4.38
    2-ethylhexanol 2.07
    isooctanol 2.79
    dipropyl ether 2.47
    1,2-dichlorobenzene 2.92
    ethyl lactate 2.58
    propylene carbonate 3.54
    n-methylformamide 3.56
    2-pentanol 2.98
    n-pentane 0.21
    1-propoxy-2-propanol 11.27
    1-methoxy-2-propyl acetate 9.42
    2-(2-methoxypropoxy) propanol 7.49
    mesitylene 1.35
    ε-caprolactone 6.49
    p-cymene 1.17
    epichlorohydrin 8.56
    1,1,1-trichloroethane 3.65
    2-aminoethanol 2.78
    morpholine-4-carbaldehyde 12.61
    sulfolane 7.42
    2,2,4-trimethylpentane 0.17
    2-methyltetrahydrofuran 4.87
    n-hexyl acetate 4.53
    isooctane 0.15
    2-(2-butoxyethoxy)ethanol 9.3
    sec-butyl acetate 2.51
    tert-butyl acetate 5.52
    decalin 0.19
    glycerin 2.81
    diglyme 16.01
    acrylic acid 2.6
    isopropyl myristate 1.46
    n-butyric acid 5.52
    acetyl acetate 3.08
    di(2-ethylhexyl) phthalate 2.9
    ethyl propionate 2.84
    nitromethane 4.38
    1,2-diethoxyethane 4.55
    benzonitrile 2.71
    trioctyl phosphate 1.75
    1-bromopropane 2.14
    gamma-valerolactone 15.94
    n-decanol 1.11
    triethyl phosphate 2.16
    4-methyl-2-pentanol 2.54
    propionitrile 2.77
    vinylene carbonate 4.07
    1,1,2-trichlorotrifluoroethane 8.16
    DMS 4.0
    cumene 1.19
    2-octanol 1.51
    2-hexanone 3.69
    octyl acetate 1.98
    limonene 1.27
    1,2-dimethoxyethane 8.79
    ethyl orthosilicate 2.58
    tributyl phosphate 1.52
    diacetone alcohol 7.0
    N,N-dimethylaniline 3.36
    acrylonitrile 2.97
    aniline 4.42
    1,3-propanediol 5.66
    bromobenzene 2.8
    dibromomethane 3.52
    1,1,2,2-tetrachloroethane 6.05
    2-methyl-cyclohexyl acetate 3.77
    tetrabutyl urea 2.4
    diisobutyl methanol 1.52
    2-phenylethanol 6.57
    styrene 1.69
    dioctyl adipate 2.58
    dimethyl sulfate 4.15
    ethyl butyrate 2.87
    methyl lactate 3.9
    butyl lactate 5.16
    diethyl carbonate 1.9
    propanediol butyl ether 6.02
    triethyl orthoformate 3.5
    p-tert-butyltoluene 1.26
    methyl 4-tert-butylbenzoate 7.4
    morpholine 10.45
    tert-butylamine 2.04
    n-dodecanol 0.59
    dimethoxymethane 10.19
    ethylene carbonate 3.44
    cyrene 7.19
    2-ethoxyethyl acetate 8.03
    2-ethylhexyl acetate 3.65
    1,2,4-trichlorobenzene 4.22
    4-methylpyridine 6.36
    dibutyl ether 1.12
    2,6-dimethyl-4-heptanol 1.52
    DEF 4.95
    dimethyl isosorbide 11.73
    tetrachloroethylene 4.59
    eugenol 8.36
    triacetin 5.51
    span 80 5.99
    1,4-butanediol 2.04
    1,1-dichloroethane 3.27
    2-methyl-1-pentanol 3.05
    methyl formate 1.86
    2-methyl-1-butanol 3.68
    n-decane 0.09
    butyronitrile 2.97
    3,7-dimethyl-1-octanol 1.6
    1-chlorooctane 0.56
    1-chlorotetradecane 0.15
    n-nonane 0.07
    undecane 0.05
    tert-butylcyclohexane 0.18
    cyclooctane 0.1
    cyclopentanol 2.96
    tetrahydropyran 5.81
    tert-amyl methyl ether 2.66
    2,5,8-trioxanonane 9.89
    1-hexene 0.73
    2-isopropoxyethanol 5.96
    2,2,2-trifluoroethanol 1.88
    methyl butyrate 2.98

    Scent© AI

1 of 4
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