Piperoleine B

Overview IFRA Request a quote

  • Identifiers

    CAS number
    30505-89-6

    Molecular formula
    C21H29NO3

    SMILES
    C1CCN(CC1)C(=O)CCCCCC/C=C/C2=CC3=C(C=C2)OCO3

    Safety labels

  • Odor profile

    Fragrance
    Spicy 36.18%
    Floral 33.89%
    Fresh 31.57%
    Jasmin 31.08%
    Herbal 29.23%
    Animal 28.09%
    Waxy 27.24%
    Fruity 25.07%
    Sweet 24.73%
    Oily 23.9%

     

    Flavor
    Herbal 36.69%
    Waxy 23.58%
    Jasmin 22.47%
    Woody 22.35%
    Warm 22.16%
    Bitter 21.65%
    Oily 21.63%
    Lovage 20.83%
    Outdoor 20.43%
    Cedarleaf 19.78%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.9

    pKa est.
    7.29 (neutral)

    Molecular weight
    343.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    522°C

    Flash point

    • 202.69 ˚C est.

  • Synonyms

    • Piperoleine B
    • 30505-89-6
    • DTXSID101317592
    • RefChem:1096345
    • DTXCID001747398
    • Piperolein B
    • PIPERROLEIN B
    • 1-[(E)-9-(1,3-Benzodioxol-5-yl)-1-oxo-8-nonenyl]piperidine
    • (8E)-9-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)non-8-en-1-one
    • (E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnon-8-en-1-one
    • CHEMBL256214
    • MEGxp0_000205
    • SCHEMBL15471329
    • ACon1_000259
    • CHEBI:177772
    • FAXXHNWVMKTOFF-UXBLZVDNSA-N
    • BDBM50479140
    • NCGC00180733-01
    • BRD-K04771916-001-01-8
    • (8E)-9-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-8-nonen-1-one
    • Piperidine, 1-[(8E)-9-(1,3-benzodioxol-5-yl)-1-oxo-8-nonenyl]-
    • (E)-9-(benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)non-8-en-1-one
    • 8-Nonen-1-one, 9-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, (8E)-
    • Piperidine, 1-[9-(1,3-benzodioxol-5-yl)-1-oxo-8-nonenyl]-, (E)-
    • Piperidine, 1-[9-[3,4-(methylenedioxy)phenyl]-8-nonenoyl]-, (E)-
    • NCGC00180733-02!(E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnon-8-en-1-one
    • 30505-89-6

  • Applications

    Piperoleine B can function as an intermediate in organic synthesis and may be used as a fragrance-related component; in the cosmetics and personal care sector, it may serve as a fragrance ingredient or formulation additive; in household and consumer cleaning products, it can act as a fragrance additive; in industrial manufacturing, it is evaluated as a specialty chemical intermediate for synthesis; in the polymers and plastics sector, it may be used as a functional additive or processing aid under formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 76.48
    methanol 69.12
    isopropanol 58.86
    water 0.15
    ethyl acetate 104.68
    n-propanol 70.96
    acetone 89.07
    n-butanol 84.56
    acetonitrile 68.83
    DMF 84.23
    toluene 67.59
    isobutanol 57.44
    1,4-dioxane 156.75
    methyl acetate 80.85
    THF 214.34
    2-butanone 105.92
    n-pentanol 66.06
    sec-butanol 69.87
    n-hexane 2.32
    ethylene glycol 11.86
    NMP 88.99
    cyclohexane 9.05
    DMSO 144.5
    n-butyl acetate 64.66
    n-octanol 22.37
    chloroform 592.94
    n-propyl acetate 81.91
    acetic acid 129.49
    dichloromethane 604.83
    cyclohexanone 187.91
    propylene glycol 23.25
    isopropyl acetate 70.27
    DMAc 185.6
    2-ethoxyethanol 128.95
    isopentanol 73.08
    n-heptane 2.02
    ethyl formate 71.44
    1,2-dichloroethane 278.96
    n-hexanol 38.77
    2-methoxyethanol 129.66
    isobutyl acetate 57.22
    tetrachloromethane 43.97
    n-pentyl acetate 60.69
    transcutol 395.61
    n-heptanol 26.03
    ethylbenzene 26.15
    MIBK 63.69
    2-propoxyethanol 98.39
    tert-butanol 48.26
    MTBE 44.74
    2-butoxyethanol 77.16
    propionic acid 68.52
    o-xylene 33.95
    formic acid 50.05
    diethyl ether 64.04
    m-xylene 32.75
    p-xylene 33.86
    chlorobenzene 93.81
    dimethyl carbonate 41.31
    n-octane 1.73
    formamide 80.75
    cyclopentanone 152.87
    2-pentanone 92.86
    anisole 57.78
    cyclopentyl methyl ether 73.02
    gamma-butyrolactone 161.46
    1-methoxy-2-propanol 97.58
    pyridine 168.91
    3-pentanone 77.15
    furfural 171.25
    n-dodecane 2.13
    diethylene glycol 77.49
    diisopropyl ether 16.74
    tert-amyl alcohol 51.43
    acetylacetone 106.48
    n-hexadecane 2.43
    acetophenone 75.67
    methyl propionate 72.79
    isopentyl acetate 65.19
    trichloroethylene 465.01
    n-nonanol 24.82
    cyclohexanol 78.61
    benzyl alcohol 67.89
    2-ethylhexanol 27.19
    isooctanol 25.38
    dipropyl ether 25.47
    1,2-dichlorobenzene 92.13
    ethyl lactate 52.86
    propylene carbonate 112.36
    n-methylformamide 53.85
    2-pentanol 50.36
    n-pentane 2.98
    1-propoxy-2-propanol 64.18
    1-methoxy-2-propyl acetate 85.76
    2-(2-methoxypropoxy) propanol 81.91
    mesitylene 18.7
    ε-caprolactone 158.04
    p-cymene 16.62
    epichlorohydrin 270.8
    1,1,1-trichloroethane 150.5
    2-aminoethanol 32.11
    morpholine-4-carbaldehyde 131.01
    sulfolane 148.99
    2,2,4-trimethylpentane 3.05
    2-methyltetrahydrofuran 130.45
    n-hexyl acetate 64.61
    isooctane 1.79
    2-(2-butoxyethoxy)ethanol 116.66
    sec-butyl acetate 59.93
    tert-butyl acetate 59.29
    decalin 4.36
    glycerin 41.11
    diglyme 215.44
    acrylic acid 61.44
    isopropyl myristate 27.49
    n-butyric acid 128.71
    acetyl acetate 76.33
    di(2-ethylhexyl) phthalate 38.74
    ethyl propionate 61.34
    nitromethane 158.38
    1,2-diethoxyethane 102.85
    benzonitrile 84.63
    trioctyl phosphate 23.87
    1-bromopropane 113.61
    gamma-valerolactone 211.69
    n-decanol 18.98
    triethyl phosphate 36.72
    4-methyl-2-pentanol 30.96
    propionitrile 67.33
    vinylene carbonate 109.56
    1,1,2-trichlorotrifluoroethane 190.41
    DMS 60.27
    cumene 18.13
    2-octanol 18.23
    2-hexanone 71.76
    octyl acetate 35.47
    limonene 20.16
    1,2-dimethoxyethane 146.28
    ethyl orthosilicate 36.67
    tributyl phosphate 32.7
    diacetone alcohol 71.62
    N,N-dimethylaniline 35.11
    acrylonitrile 73.9
    aniline 77.1
    1,3-propanediol 72.24
    bromobenzene 99.29
    dibromomethane 321.89
    1,1,2,2-tetrachloroethane 351.1
    2-methyl-cyclohexyl acetate 53.75
    tetrabutyl urea 41.54
    diisobutyl methanol 16.44
    2-phenylethanol 57.1
    styrene 34.39
    dioctyl adipate 48.69
    dimethyl sulfate 63.8
    ethyl butyrate 56.32
    methyl lactate 48.28
    butyl lactate 55.79
    diethyl carbonate 45.3
    propanediol butyl ether 61.65
    triethyl orthoformate 49.48
    p-tert-butyltoluene 13.32
    methyl 4-tert-butylbenzoate 64.68
    morpholine 177.64
    tert-butylamine 25.51
    n-dodecanol 14.89
    dimethoxymethane 101.29
    ethylene carbonate 103.19
    cyrene 79.52
    2-ethoxyethyl acetate 102.44
    2-ethylhexyl acetate 54.7
    1,2,4-trichlorobenzene 102.36
    4-methylpyridine 128.06
    dibutyl ether 34.18
    2,6-dimethyl-4-heptanol 16.44
    DEF 100.08
    dimethyl isosorbide 115.77
    tetrachloroethylene 225.85
    eugenol 70.39
    triacetin 90.42
    span 80 61.43
    1,4-butanediol 40.66
    1,1-dichloroethane 199.16
    2-methyl-1-pentanol 63.47
    methyl formate 45.09
    2-methyl-1-butanol 70.95
    n-decane 3.35
    butyronitrile 83.0
    3,7-dimethyl-1-octanol 26.2
    1-chlorooctane 16.94
    1-chlorotetradecane 7.81
    n-nonane 2.63
    undecane 2.59
    tert-butylcyclohexane 3.02
    cyclooctane 2.86
    cyclopentanol 64.31
    tetrahydropyran 151.68
    tert-amyl methyl ether 38.9
    2,5,8-trioxanonane 158.27
    1-hexene 13.63
    2-isopropoxyethanol 93.99
    2,2,2-trifluoroethanol 61.43
    methyl butyrate 85.1

    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