Npc68122

Overview IFRA Request a quote

  • Identifiers

    CAS number
    100665-42-7

    Molecular formula
    C30H44O7

    SMILES
    CC(CC(=O)/C=C(/C)\[C@H]1C[C@@H]([C@@]2([C@@]1(CC(=O)C3=C2[C@H](C[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)O)C)C)O)C(=O)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 57.09%
    Odorless 36.27%
    Dry 31.3%
    Mint 31.0%
    Sweet 28.75%
    Cedar 27.98%
    Cooling 27.84%
    Spicy 27.1%
    Amber 27.08%
    Camphoreous 25.58%

     

    Flavor
    Bitter 83.8%
    Odorless 27.44%
    Bland 23.76%
    Cedarleaf 21.9%
    Sweet-like 21.42%
    Ripe apricot 19.95%
    Parsley 19.9%
    Leaves 19.75%
    Heather 19.74%
    Red fruit 19.68%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    2.7

    pKa est.
    4.72 (weak acid)

    Molecular weight
    516.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    626°C

    Flash point

    • 289.12 ˚C est.

  • Synonyms

    • RefChem:1093251
    • Npc68122
    • Ganoderenic acid c
    • 100665-42-7
    • (Z)-2-methyl-4-oxo-6-[(3S,5R,7S,10S,13R,14R,15S,17R)-3,7,15-trihydroxy-4,4,10,13,14-pentamethyl-11-oxo-1,2,3,5,6,7,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-5-enoic acid
    • (20E)-3beta,7beta,15alpha-Trihydroxy-11,23-dioxo-5alpha-lanosta-8,20(22)-dien-26-oic acid
    • SCHEMBL29934651
    • CHEBI:168536
    • AEA66542
    • DA-53492
    • 100665-42-7

  • Applications

    Npc68122 (CAS 100665-42-7) is typically evaluated for use across several industrial applications, including as an intermediate in organic synthesis; as a solvent or processing aid in coatings, inks, and cleaning formulations; as a plasticizer or stabilizer in polymer systems; and as an additive in adhesives and electronics manufacturing. Its exact role depends on formulation and regulatory compliance, and uses would be subject to local regulations and purity requirements.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 31.33
    methanol 60.62
    isopropanol 11.92
    water 0.05
    ethyl acetate 3.26
    n-propanol 17.4
    acetone 17.09
    n-butanol 7.1
    acetonitrile 4.14
    DMF 114.86
    toluene 0.93
    isobutanol 5.73
    1,4-dioxane 30.11
    methyl acetate 5.46
    THF 95.65
    2-butanone 9.47
    n-pentanol 4.85
    sec-butanol 3.69
    n-hexane 0.07
    ethylene glycol 8.58
    NMP 48.7
    cyclohexane 0.08
    DMSO 103.25
    n-butyl acetate 2.45
    n-octanol 1.4
    chloroform 10.38
    n-propyl acetate 2.61
    acetic acid 26.24
    dichloromethane 6.95
    cyclohexanone 12.99
    propylene glycol 10.85
    isopropyl acetate 2.1
    DMAc 55.51
    2-ethoxyethanol 29.35
    isopentanol 3.03
    n-heptane 0.04
    ethyl formate 4.87
    1,2-dichloroethane 4.14
    n-hexanol 3.48
    2-methoxyethanol 70.78
    isobutyl acetate 1.51
    tetrachloromethane 1.05
    n-pentyl acetate 3.05
    transcutol 16.37
    n-heptanol 2.59
    ethylbenzene 0.53
    MIBK 2.57
    2-propoxyethanol 34.22
    tert-butanol 4.77
    MTBE 1.6
    2-butoxyethanol 14.72
    propionic acid 6.95
    o-xylene 0.48
    formic acid 22.06
    diethyl ether 3.2
    m-xylene 0.53
    p-xylene 0.66
    chlorobenzene 1.31
    dimethyl carbonate 6.2
    n-octane 0.03
    formamide 26.3
    cyclopentanone 33.39
    2-pentanone 5.19
    anisole 2.52
    cyclopentyl methyl ether 5.57
    gamma-butyrolactone 31.43
    1-methoxy-2-propanol 34.43
    pyridine 15.06
    3-pentanone 3.51
    furfural 19.19
    n-dodecane 0.02
    diethylene glycol 31.08
    diisopropyl ether 0.36
    tert-amyl alcohol 2.35
    acetylacetone 7.65
    n-hexadecane 0.02
    acetophenone 3.3
    methyl propionate 5.75
    isopentyl acetate 2.08
    trichloroethylene 9.38
    n-nonanol 1.45
    cyclohexanol 2.12
    benzyl alcohol 5.08
    2-ethylhexanol 0.89
    isooctanol 1.55
    dipropyl ether 1.38
    1,2-dichlorobenzene 1.12
    ethyl lactate 3.24
    propylene carbonate 6.77
    n-methylformamide 41.93
    2-pentanol 1.65
    n-pentane 0.07
    1-propoxy-2-propanol 12.32
    1-methoxy-2-propyl acetate 6.2
    2-(2-methoxypropoxy) propanol 6.36
    mesitylene 0.27
    ε-caprolactone 9.86
    p-cymene 0.26
    epichlorohydrin 34.85
    1,1,1-trichloroethane 2.0
    2-aminoethanol 21.97
    morpholine-4-carbaldehyde 62.44
    sulfolane 41.5
    2,2,4-trimethylpentane 0.02
    2-methyltetrahydrofuran 11.39
    n-hexyl acetate 3.13
    isooctane 0.02
    2-(2-butoxyethoxy)ethanol 10.26
    sec-butyl acetate 1.19
    tert-butyl acetate 2.04
    decalin 0.05
    glycerin 20.62
    diglyme 19.46
    acrylic acid 9.01
    isopropyl myristate 0.6
    n-butyric acid 6.96
    acetyl acetate 2.43
    di(2-ethylhexyl) phthalate 1.82
    ethyl propionate 2.04
    nitromethane 32.83
    1,2-diethoxyethane 3.73
    benzonitrile 2.83
    trioctyl phosphate 1.15
    1-bromopropane 1.43
    gamma-valerolactone 65.81
    n-decanol 0.71
    triethyl phosphate 1.1
    4-methyl-2-pentanol 0.9
    propionitrile 3.48
    vinylene carbonate 7.94
    1,1,2-trichlorotrifluoroethane 26.52
    DMS 3.32
    cumene 0.33
    2-octanol 0.98
    2-hexanone 3.94
    octyl acetate 1.2
    limonene 0.33
    1,2-dimethoxyethane 31.01
    ethyl orthosilicate 1.02
    tributyl phosphate 0.97
    diacetone alcohol 6.09
    N,N-dimethylaniline 1.86
    acrylonitrile 6.29
    aniline 2.94
    1,3-propanediol 29.13
    bromobenzene 0.96
    dibromomethane 3.45
    1,1,2,2-tetrachloroethane 7.69
    2-methyl-cyclohexyl acetate 1.78
    tetrabutyl urea 1.87
    diisobutyl methanol 0.41
    2-phenylethanol 4.79
    styrene 0.58
    dioctyl adipate 1.57
    dimethyl sulfate 11.81
    ethyl butyrate 1.51
    methyl lactate 8.78
    butyl lactate 4.14
    diethyl carbonate 1.06
    propanediol butyl ether 11.32
    triethyl orthoformate 1.63
    p-tert-butyltoluene 0.24
    methyl 4-tert-butylbenzoate 4.17
    morpholine 45.97
    tert-butylamine 0.99
    n-dodecanol 0.35
    dimethoxymethane 49.51
    ethylene carbonate 6.01
    cyrene 12.24
    2-ethoxyethyl acetate 6.78
    2-ethylhexyl acetate 1.41
    1,2,4-trichlorobenzene 1.84
    4-methylpyridine 7.62
    dibutyl ether 0.67
    2,6-dimethyl-4-heptanol 0.41
    DEF 8.03
    dimethyl isosorbide 11.04
    tetrachloroethylene 5.59
    eugenol 5.81
    triacetin 3.92
    span 80 5.7
    1,4-butanediol 9.72
    1,1-dichloroethane 2.75
    2-methyl-1-pentanol 2.21
    methyl formate 22.66
    2-methyl-1-butanol 2.86
    n-decane 0.04
    butyronitrile 2.85
    3,7-dimethyl-1-octanol 0.76
    1-chlorooctane 0.3
    1-chlorotetradecane 0.07
    n-nonane 0.04
    undecane 0.03
    tert-butylcyclohexane 0.04
    cyclooctane 0.03
    cyclopentanol 6.72
    tetrahydropyran 9.99
    tert-amyl methyl ether 1.11
    2,5,8-trioxanonane 10.63
    1-hexene 0.4
    2-isopropoxyethanol 10.37
    2,2,2-trifluoroethanol 7.58
    methyl butyrate 3.07

    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