Faradiol 3-o-laurate

Overview IFRA Request a quote

  • Identifiers

    CAS number
    270078-40-5

    Molecular formula
    C42H72O3

    SMILES
    CCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@@H]4[C@H]5[C@@H](C(=CC[C@@]5([C@H](C[C@]4([C@@]3(CC[C@H]2C1(C)C)C)C)O)C)C)C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 83.32%
    Sandalwood 55.3%
    Amber 51.73%
    Balsamic 44.14%
    Dry 42.17%
    Cedar 40.25%
    Vetiver 35.86%
    Waxy 34.77%
    Musk 34.41%
    Powdery 32.02%

     

    Flavor
    Woody 59.66%
    Balsam 37.38%
    Herbal 34.28%
    Sweet 33.11%
    Pine 32.26%
    Wood 29.97%
    Camphor 28.31%
    Earthy 26.0%
    Mild 25.86%
    Herb 25.32%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    13.3

    pKa est.
    5.34 (weak acid)

    Molecular weight
    625.0 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    642°C

    Flash point

    • 240.22 ˚C est.

  • Synonyms

    • Faradiol 3-laurate
    • Faradiol 3-o-laurate
    • Faradiol 3-monolaurate
    • BS4CLY2VQP
    • UNII-BS4CLY2VQP
    • RefChem:36739
    • 270078-40-5
    • URS-20-ene-3,16-diol, 3-dodecanoate, (3beta,16beta,18alpha,19alpha)-
    • DTXSID701210883
    • 16beta-Hydroxy-18alpha,19alpha-urs-20-en-3beta-yl dodecanoate
    • URS-20-ENE-3,16-DIOL, 3-DODECANOATE, (3.BETA.,16.BETA.,18.ALPHA.,19.ALPHA.)-
    • Urs-20-ene-3,16-diol, 3-dodecanoate, (3I(2),16I(2),18I+/-,19I+/-)-
    • 270078-40-5

  • Applications

    Faradiol 3-o-laurate is a lipophilic ester that may be used as a fragrance-related ingredient and fixative in perfumery; in cosmetics and personal care it can serve as an emollient or carrier component; in coatings, inks, and adhesives it can function as a processing additive to influence solubility, gloss, and compatibility with natural resin systems; in polymer and plastics formulations it may act as a lipophilic modifier or plasticizer to adjust rheology and compatibility with bio-based binders; and in industrial chemical manufacturing it may be employed as a precursor or intermediate in the synthesis of other terpenoid derivatives.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 6.19
    methanol 3.48
    isopropanol 5.23
    water 0.01
    ethyl acetate 9.17
    n-propanol 11.13
    acetone 9.44
    n-butanol 11.28
    acetonitrile 2.46
    DMF 21.15
    toluene 16.69
    isobutanol 8.28
    1,4-dioxane 23.52
    methyl acetate 7.85
    THF 45.51
    2-butanone 16.6
    n-pentanol 11.46
    sec-butanol 6.91
    n-hexane 1.06
    ethylene glycol 0.48
    NMP 47.04
    cyclohexane 1.21
    DMSO 9.7
    n-butyl acetate 12.61
    n-octanol 6.32
    chloroform 34.4
    n-propyl acetate 9.0
    acetic acid 7.22
    dichloromethane 21.38
    cyclohexanone 31.61
    propylene glycol 1.53
    isopropyl acetate 9.15
    DMAc 41.76
    2-ethoxyethanol 13.51
    isopentanol 8.76
    n-heptane 0.95
    ethyl formate 4.85
    1,2-dichloroethane 12.83
    n-hexanol 11.47
    2-methoxyethanol 12.19
    isobutyl acetate 8.77
    tetrachloromethane 7.02
    n-pentyl acetate 18.8
    transcutol 30.82
    n-heptanol 10.3
    ethylbenzene 8.89
    MIBK 10.57
    2-propoxyethanol 29.39
    tert-butanol 4.54
    MTBE 8.39
    2-butoxyethanol 25.05
    propionic acid 7.28
    o-xylene 9.49
    formic acid 2.0
    diethyl ether 10.8
    m-xylene 10.05
    p-xylene 9.01
    chlorobenzene 15.67
    dimethyl carbonate 6.96
    n-octane 0.35
    formamide 2.69
    cyclopentanone 34.18
    2-pentanone 14.58
    anisole 14.59
    cyclopentyl methyl ether 21.84
    gamma-butyrolactone 27.73
    1-methoxy-2-propanol 15.44
    pyridine 28.66
    3-pentanone 14.18
    furfural 21.33
    n-dodecane 0.18
    diethylene glycol 8.26
    diisopropyl ether 3.34
    tert-amyl alcohol 6.11
    acetylacetone 12.68
    n-hexadecane 0.22
    acetophenone 15.13
    methyl propionate 12.02
    isopentyl acetate 14.42
    trichloroethylene 29.67
    n-nonanol 7.72
    cyclohexanol 10.03
    benzyl alcohol 12.72
    2-ethylhexanol 7.46
    isooctanol 8.35
    dipropyl ether 10.24
    1,2-dichlorobenzene 14.98
    ethyl lactate 6.15
    propylene carbonate 12.73
    n-methylformamide 7.21
    2-pentanol 6.39
    n-pentane 0.96
    1-propoxy-2-propanol 21.96
    1-methoxy-2-propyl acetate 20.28
    2-(2-methoxypropoxy) propanol 17.94
    mesitylene 5.16
    ε-caprolactone 29.26
    p-cymene 5.41
    epichlorohydrin 29.6
    1,1,1-trichloroethane 13.89
    2-aminoethanol 2.61
    morpholine-4-carbaldehyde 38.22
    sulfolane 32.53
    2,2,4-trimethylpentane 0.78
    2-methyltetrahydrofuran 24.08
    n-hexyl acetate 18.37
    isooctane 0.54
    2-(2-butoxyethoxy)ethanol 21.95
    sec-butyl acetate 8.16
    tert-butyl acetate 10.69
    decalin 1.16
    glycerin 2.63
    diglyme 36.13
    acrylic acid 6.21
    isopropyl myristate 5.88
    n-butyric acid 12.94
    acetyl acetate 7.15
    di(2-ethylhexyl) phthalate 9.72
    ethyl propionate 8.98
    nitromethane 9.35
    1,2-diethoxyethane 13.28
    benzonitrile 9.01
    trioctyl phosphate 6.78
    1-bromopropane 10.19
    gamma-valerolactone 50.65
    n-decanol 4.29
    triethyl phosphate 7.33
    4-methyl-2-pentanol 4.62
    propionitrile 5.76
    vinylene carbonate 14.61
    1,1,2-trichlorotrifluoroethane 21.21
    DMS 12.86
    cumene 5.51
    2-octanol 5.53
    2-hexanone 13.63
    octyl acetate 8.32
    limonene 6.16
    1,2-dimethoxyethane 20.48
    ethyl orthosilicate 8.57
    tributyl phosphate 6.1
    diacetone alcohol 12.35
    N,N-dimethylaniline 12.42
    acrylonitrile 5.81
    aniline 14.09
    1,3-propanediol 5.83
    bromobenzene 17.01
    dibromomethane 15.29
    1,1,2,2-tetrachloroethane 24.94
    2-methyl-cyclohexyl acetate 13.7
    tetrabutyl urea 10.1
    diisobutyl methanol 3.94
    2-phenylethanol 15.77
    styrene 8.63
    dioctyl adipate 10.46
    dimethyl sulfate 12.4
    ethyl butyrate 10.43
    methyl lactate 7.43
    butyl lactate 16.02
    diethyl carbonate 6.2
    propanediol butyl ether 13.59
    triethyl orthoformate 11.51
    p-tert-butyltoluene 5.2
    methyl 4-tert-butylbenzoate 22.26
    morpholine 30.84
    tert-butylamine 3.01
    n-dodecanol 2.35
    dimethoxymethane 20.04
    ethylene carbonate 11.89
    cyrene 20.41
    2-ethoxyethyl acetate 24.48
    2-ethylhexyl acetate 13.0
    1,2,4-trichlorobenzene 20.47
    4-methylpyridine 25.09
    dibutyl ether 5.54
    2,6-dimethyl-4-heptanol 3.94
    DEF 18.27
    dimethyl isosorbide 29.08
    tetrachloroethylene 17.86
    eugenol 21.27
    triacetin 18.01
    span 80 16.77
    1,4-butanediol 2.98
    1,1-dichloroethane 11.29
    2-methyl-1-pentanol 9.51
    methyl formate 4.64
    2-methyl-1-butanol 9.86
    n-decane 0.52
    butyronitrile 6.51
    3,7-dimethyl-1-octanol 5.35
    1-chlorooctane 3.21
    1-chlorotetradecane 0.78
    n-nonane 0.42
    undecane 0.28
    tert-butylcyclohexane 1.05
    cyclooctane 0.65
    cyclopentanol 10.2
    tetrahydropyran 25.6
    tert-amyl methyl ether 8.28
    2,5,8-trioxanonane 21.48
    1-hexene 4.37
    2-isopropoxyethanol 11.72
    2,2,2-trifluoroethanol 3.75
    methyl butyrate 10.92

    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