Gangaleoidin

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  • Identifiers

    CAS number
    55365-63-4

    Molecular formula
    C18H14Cl2O7

    SMILES
    CC1=C2C(=C(C(=C1Cl)O)Cl)OC3=C(C(=C(C=C3OC2=O)OC)C(=O)OC)C

    Safety labels

  • Odor profile

    Fragrance
    Phenolic 46.73%
    Odorless 42.55%
    Spicy 31.54%
    Woody 29.84%
    Dry 29.46%
    Burnt 28.89%
    Powdery 28.34%
    Sweet 28.17%
    Smoky 26.5%
    Vanilla 25.75%

     

    Flavor
    Bitter 87.17%
    Odorless 30.54%
    Bland 28.85%
    Sweet-like 21.14%
    Parsley 21.11%
    Cedarleaf 20.81%
    Lovage 19.55%
    Ripe apricot 19.38%
    Eugenol 19.33%
    Red fruit 19.32%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.4

    pKa est.
    5.92 (weak acid)

    Molecular weight
    413.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    782°C

    Flash point

    • 211.7 ˚C est.

  • Synonyms

    • GANGALEOIDIN
    • methyl 8,10-dichloro-9-hydroxy-3-methoxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylate
    • methyl 8,10-dichloro-9-hydroxy-3-methoxy-1,7-dimethyl-6-oxobenzo(b)(1,4)benzodioxepine-2-carboxylate
    • RefChem:142391
    • 55365-63-4
    • CHEMBL1491099
    • KBio3_001118
    • Spectrum_000214
    • SpecPlus_000288
    • Spectrum2_000294
    • Spectrum3_000159
    • Spectrum4_000939
    • Spectrum5_001630
    • BSPBio_001898
    • KBioGR_001498
    • KBioSS_000694
    • SPECTRUM200035
    • DivK1c_006384
    • SPBio_000228
    • SCHEMBL17988246
    • KBio1_001328
    • KBio2_000694
    • KBio2_003262
    • KBio2_005830
    • CHEBI:107639
    • DTXSID501346999
    • BDBM50442899
    • CCG-39852
    • SDCCGMLS-0066459.P001
    • NCGC00095466-01
    • NCGC00095466-02
    • NCGC00095466-03
    • NCGC00095466-04
    • DB-243669
    • NS00134219
    • SR-05000002654
    • SR-05000002654-1
    • BRD-K41603276-001-01-2
    • BRD-K41603276-001-03-8
    • Q27185962
    • 8,10-dichloro-9-hydroxy-3-methoxy-1,7-dimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester
    • Methyl 2,4-dichloro-3-hydroxy-8-methoxy-1,6-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylate
    • 55365-63-4

  • Applications

    Gangaleoidin (CAS 55365-63-4) is an organic compound that may be used as a synthesis intermediate and/or a specialty solvent in various industrial applications. In practice, it may serve as an intermediate in organic synthesis and as a solvent for formulation systems with specific requirements. It may also function as a precursor or building block for polymers or dyes, and be employed as a processing aid in coatings and printing inks. In addition, its properties may allow it to act as a stabilizer or chelating agent in formulations, depending on usage conditions and local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2.69
    methanol 2.54
    isopropanol 2.59
    water 0.0
    ethyl acetate 25.07
    n-propanol 3.79
    acetone 25.27
    n-butanol 3.58
    acetonitrile 8.73
    DMF 71.84
    toluene 6.38
    isobutanol 3.41
    1,4-dioxane 40.14
    methyl acetate 26.21
    THF 86.25
    2-butanone 27.09
    n-pentanol 4.58
    sec-butanol 4.02
    n-hexane 0.32
    ethylene glycol 2.51
    NMP 134.37
    cyclohexane 0.47
    DMSO 66.05
    n-butyl acetate 22.37
    n-octanol 3.38
    chloroform 39.53
    n-propyl acetate 23.61
    acetic acid 17.65
    dichloromethane 42.39
    cyclohexanone 47.71
    propylene glycol 2.24
    isopropyl acetate 18.37
    DMAc 106.85
    2-ethoxyethanol 20.8
    isopentanol 4.44
    n-heptane 0.45
    ethyl formate 14.47
    1,2-dichloroethane 26.35
    n-hexanol 5.44
    2-methoxyethanol 26.39
    isobutyl acetate 14.74
    tetrachloromethane 4.48
    n-pentyl acetate 17.33
    transcutol 28.77
    n-heptanol 4.98
    ethylbenzene 4.68
    MIBK 14.8
    2-propoxyethanol 33.89
    tert-butanol 5.23
    MTBE 8.15
    2-butoxyethanol 18.7
    propionic acid 13.37
    o-xylene 5.34
    formic acid 8.0
    diethyl ether 8.6
    m-xylene 4.55
    p-xylene 7.23
    chlorobenzene 12.39
    dimethyl carbonate 34.32
    n-octane 0.29
    formamide 16.02
    cyclopentanone 72.98
    2-pentanone 20.58
    anisole 17.05
    cyclopentyl methyl ether 22.47
    gamma-butyrolactone 102.26
    1-methoxy-2-propanol 20.52
    pyridine 37.99
    3-pentanone 21.89
    furfural 76.12
    n-dodecane 0.33
    diethylene glycol 30.21
    diisopropyl ether 3.44
    tert-amyl alcohol 6.95
    acetylacetone 42.58
    n-hexadecane 0.41
    acetophenone 27.13
    methyl propionate 31.19
    isopentyl acetate 19.56
    trichloroethylene 68.13
    n-nonanol 4.2
    cyclohexanol 7.66
    benzyl alcohol 15.75
    2-ethylhexanol 6.26
    isooctanol 5.15
    dipropyl ether 9.81
    1,2-dichlorobenzene 14.89
    ethyl lactate 18.14
    propylene carbonate 47.3
    n-methylformamide 21.77
    2-pentanol 3.34
    n-pentane 0.24
    1-propoxy-2-propanol 22.92
    1-methoxy-2-propyl acetate 37.84
    2-(2-methoxypropoxy) propanol 25.16
    mesitylene 2.79
    ε-caprolactone 47.99
    p-cymene 4.98
    epichlorohydrin 84.34
    1,1,1-trichloroethane 20.26
    2-aminoethanol 3.9
    morpholine-4-carbaldehyde 102.0
    sulfolane 132.48
    2,2,4-trimethylpentane 0.36
    2-methyltetrahydrofuran 33.72
    n-hexyl acetate 14.58
    isooctane 0.21
    2-(2-butoxyethoxy)ethanol 22.55
    sec-butyl acetate 16.74
    tert-butyl acetate 22.62
    decalin 0.68
    glycerin 9.25
    diglyme 45.24
    acrylic acid 18.18
    isopropyl myristate 8.82
    n-butyric acid 13.62
    acetyl acetate 26.78
    di(2-ethylhexyl) phthalate 13.22
    ethyl propionate 24.41
    nitromethane 57.12
    1,2-diethoxyethane 17.37
    benzonitrile 17.52
    trioctyl phosphate 9.22
    1-bromopropane 8.47
    gamma-valerolactone 101.65
    n-decanol 3.4
    triethyl phosphate 18.38
    4-methyl-2-pentanol 3.21
    propionitrile 9.8
    vinylene carbonate 44.52
    1,1,2-trichlorotrifluoroethane 75.4
    DMS 31.31
    cumene 3.59
    2-octanol 3.53
    2-hexanone 21.02
    octyl acetate 10.56
    limonene 6.39
    1,2-dimethoxyethane 46.49
    ethyl orthosilicate 15.15
    tributyl phosphate 10.32
    diacetone alcohol 25.69
    N,N-dimethylaniline 13.14
    acrylonitrile 18.48
    aniline 12.65
    1,3-propanediol 6.41
    bromobenzene 12.83
    dibromomethane 20.02
    1,1,2,2-tetrachloroethane 47.73
    2-methyl-cyclohexyl acetate 21.14
    tetrabutyl urea 17.45
    diisobutyl methanol 4.56
    2-phenylethanol 18.15
    styrene 5.77
    dioctyl adipate 16.8
    dimethyl sulfate 74.41
    ethyl butyrate 23.1
    methyl lactate 25.04
    butyl lactate 15.25
    diethyl carbonate 19.18
    propanediol butyl ether 11.22
    triethyl orthoformate 19.28
    p-tert-butyltoluene 4.81
    methyl 4-tert-butylbenzoate 25.8
    morpholine 40.51
    tert-butylamine 2.28
    n-dodecanol 2.74
    dimethoxymethane 46.09
    ethylene carbonate 34.42
    cyrene 50.99
    2-ethoxyethyl acetate 29.9
    2-ethylhexyl acetate 17.92
    1,2,4-trichlorobenzene 22.81
    4-methylpyridine 29.08
    dibutyl ether 5.72
    2,6-dimethyl-4-heptanol 4.56
    DEF 37.9
    dimethyl isosorbide 58.12
    tetrachloroethylene 30.76
    eugenol 27.82
    triacetin 29.06
    span 80 18.16
    1,4-butanediol 4.17
    1,1-dichloroethane 16.61
    2-methyl-1-pentanol 6.39
    methyl formate 24.26
    2-methyl-1-butanol 4.71
    n-decane 0.48
    butyronitrile 7.75
    3,7-dimethyl-1-octanol 4.4
    1-chlorooctane 2.73
    1-chlorotetradecane 1.56
    n-nonane 0.38
    undecane 0.39
    tert-butylcyclohexane 0.57
    cyclooctane 0.22
    cyclopentanol 10.74
    tetrahydropyran 18.77
    tert-amyl methyl ether 10.2
    2,5,8-trioxanonane 38.79
    1-hexene 1.9
    2-isopropoxyethanol 17.81
    2,2,2-trifluoroethanol 15.54
    methyl butyrate 27.61

    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