Bullatalicin

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  • Identifiers

    CAS number
    152323-84-7

    Molecular formula
    C37H66O8

    SMILES
    CCCCCCCCCCC(C1CCC(O1)C(CCC(C2CCC(O2)CCCCCCCC(CC3=CC(OC3=O)C)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Oily 36.02%
    Odorless 34.09%
    Lactonic 32.62%
    Peach 30.52%
    Fruity 30.44%
    Sweet 28.58%
    Fresh 28.27%
    Milky 26.19%
    Fatty 25.62%
    Waxy 23.96%

     

    Flavor
    Fatty 31.36%
    Odorless 28.27%
    Bland 27.91%
    Mild 26.49%
    Bitter 23.69%
    Waxy 22.75%
    Oily 22.23%
    Sweet-like 21.91%
    Herbal 21.15%
    Cedarleaf 21.12%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    8.2

    pKa est.
    8.13 (weak base)

    Molecular weight
    638.9 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1999°C

    Melting point expt.

    • 107 - 109 °C

    Flash point

    • 246.98 ˚C est.

  • Synonyms

    • Bullatalicin
    • 152323-84-7
    • 4-[9-[5-[1,4-dihydroxy-4-[5-(1-hydroxyundecyl)oxolan-2-yl]butyl]oxolan-2-yl]-2-hydroxynonyl]-2-methyl-2H-furan-5-one
    • 4-(9-(5-(1,4-dihydroxy-4-(5-(1-hydroxyundecyl)oxolan-2-yl)butyl)oxolan-2-yl)-2-hydroxynonyl)-2-methyl-2H-furan-5-one
    • RefChem:917707
    • Purpureacin-1
    • 125882-64-6
    • Annonin IV
    • Crassiflorin
    • NSC634802
    • Purpureacin 1
    • Cherimolin 2
    • 150134-21-7
    • CHEBI:8643
    • DTXSID80925308
    • C08505
    • Q27108124
    • 2(5H)-Furanone, 3-(9-(5-(1,4-dihydroxy-4-(tetrahydro-5-(1-hydroxyundecyl)-2-furanyl)butyl)tetrahydro-2-furanyl)-2-hydroxynonyl)-5-methyl-
    • 3-(9-(5-(1,4-Dihydroxy-4-(5-(1-hydroxyundecyl)tetrahydro-2-furanyl)butyl)tetrahydro-2-furanyl)-2-hydroxynonyl)-5-methyl-2(5H)-furanone
    • 3-[9-(5-{1,4-Dihydroxy-4-[5-(1-hydroxyundecyl)oxolan-2-yl]butyl}oxolan-2-yl)-2-hydroxynonyl]-5-methylfuran-2(5H)-one
    • 4-[9-[5-[1,4-dihydroxy-4-[5-(1-hydroxyundecyl)tetrahydrofuran-2-yl]butyl]tetrahydrofuran-2-yl]-2-hydroxy-nonyl]-2-methyl-2H-furan-5-one
    • 152323-84-7

  • Applications

    Bullatalicin (CAS 152323-84-7) is typically viewed as an intermediate in organic synthesis and as a solvent or processing aid in industrial manufacturing. It may function as a stabilizer or additive in polymer formulations, helping to improve physical properties. It can also serve as a component in coatings and inks as an additive, and may be used in cleaning formulations as a solvent or dispersing agent, depending on formulation needs and local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3.85
    methanol 7.81
    isopropanol 1.45
    water 0.1
    ethyl acetate 8.35
    n-propanol 4.22
    acetone 8.19
    n-butanol 3.78
    acetonitrile 2.38
    DMF 23.19
    toluene 3.63
    isobutanol 2.32
    1,4-dioxane 16.65
    methyl acetate 6.71
    THF 52.55
    2-butanone 10.9
    n-pentanol 3.59
    sec-butanol 2.61
    n-hexane 0.21
    ethylene glycol 1.01
    NMP 92.21
    cyclohexane 0.35
    DMSO 31.41
    n-butyl acetate 6.09
    n-octanol 6.0
    chloroform 34.17
    n-propyl acetate 6.41
    acetic acid 19.72
    dichloromethane 31.57
    cyclohexanone 31.04
    propylene glycol 2.1
    isopropyl acetate 7.0
    DMAc 71.5
    2-ethoxyethanol 17.22
    isopentanol 3.01
    n-heptane 0.28
    ethyl formate 7.03
    1,2-dichloroethane 12.35
    n-hexanol 2.67
    2-methoxyethanol 20.4
    isobutyl acetate 4.23
    tetrachloromethane 3.81
    n-pentyl acetate 16.54
    transcutol 72.11
    n-heptanol 5.35
    ethylbenzene 2.6
    MIBK 6.43
    2-propoxyethanol 17.34
    tert-butanol 1.64
    MTBE 3.45
    2-butoxyethanol 23.44
    propionic acid 9.17
    o-xylene 3.26
    formic acid 11.44
    diethyl ether 3.24
    m-xylene 2.84
    p-xylene 2.6
    chlorobenzene 6.64
    dimethyl carbonate 8.62
    n-octane 0.2
    formamide 13.07
    cyclopentanone 42.6
    2-pentanone 10.08
    anisole 8.04
    cyclopentyl methyl ether 16.23
    gamma-butyrolactone 54.09
    1-methoxy-2-propanol 15.99
    pyridine 16.79
    3-pentanone 9.0
    furfural 44.17
    n-dodecane 0.17
    diethylene glycol 8.38
    diisopropyl ether 1.13
    tert-amyl alcohol 3.23
    acetylacetone 17.34
    n-hexadecane 0.21
    acetophenone 13.03
    methyl propionate 10.71
    isopentyl acetate 6.68
    trichloroethylene 36.36
    n-nonanol 6.65
    cyclohexanol 5.36
    benzyl alcohol 7.65
    2-ethylhexanol 2.44
    isooctanol 4.41
    dipropyl ether 3.74
    1,2-dichlorobenzene 8.99
    ethyl lactate 8.01
    propylene carbonate 25.15
    n-methylformamide 12.73
    2-pentanol 2.09
    n-pentane 0.16
    1-propoxy-2-propanol 12.9
    1-methoxy-2-propyl acetate 14.84
    2-(2-methoxypropoxy) propanol 21.46
    mesitylene 1.45
    ε-caprolactone 43.68
    p-cymene 1.86
    epichlorohydrin 50.54
    1,1,1-trichloroethane 9.66
    2-aminoethanol 3.44
    morpholine-4-carbaldehyde 64.02
    sulfolane 95.91
    2,2,4-trimethylpentane 0.25
    2-methyltetrahydrofuran 21.48
    n-hexyl acetate 18.44
    isooctane 0.12
    2-(2-butoxyethoxy)ethanol 30.75
    sec-butyl acetate 5.41
    tert-butyl acetate 9.23
    decalin 0.46
    glycerin 6.37
    diglyme 57.73
    acrylic acid 10.47
    isopropyl myristate 4.5
    n-butyric acid 15.84
    acetyl acetate 9.02
    di(2-ethylhexyl) phthalate 7.12
    ethyl propionate 7.26
    nitromethane 29.76
    1,2-diethoxyethane 12.86
    benzonitrile 5.93
    trioctyl phosphate 5.06
    1-bromopropane 4.33
    gamma-valerolactone 96.48
    n-decanol 3.6
    triethyl phosphate 6.2
    4-methyl-2-pentanol 1.61
    propionitrile 2.48
    vinylene carbonate 23.65
    1,1,2-trichlorotrifluoroethane 57.78
    DMS 10.38
    cumene 1.89
    2-octanol 3.39
    2-hexanone 7.53
    octyl acetate 7.77
    limonene 2.75
    1,2-dimethoxyethane 21.55
    ethyl orthosilicate 6.35
    tributyl phosphate 5.54
    diacetone alcohol 13.97
    N,N-dimethylaniline 7.04
    acrylonitrile 4.49
    aniline 5.88
    1,3-propanediol 5.46
    bromobenzene 6.86
    dibromomethane 13.42
    1,1,2,2-tetrachloroethane 32.06
    2-methyl-cyclohexyl acetate 8.87
    tetrabutyl urea 8.77
    diisobutyl methanol 1.41
    2-phenylethanol 6.63
    styrene 2.68
    dioctyl adipate 9.8
    dimethyl sulfate 25.12
    ethyl butyrate 6.58
    methyl lactate 12.94
    butyl lactate 17.56
    diethyl carbonate 4.16
    propanediol butyl ether 18.94
    triethyl orthoformate 8.69
    p-tert-butyltoluene 1.72
    methyl 4-tert-butylbenzoate 23.35
    morpholine 27.61
    tert-butylamine 0.81
    n-dodecanol 2.0
    dimethoxymethane 19.06
    ethylene carbonate 18.26
    cyrene 29.54
    2-ethoxyethyl acetate 28.6
    2-ethylhexyl acetate 5.84
    1,2,4-trichlorobenzene 13.1
    4-methylpyridine 13.2
    dibutyl ether 5.33
    2,6-dimethyl-4-heptanol 1.41
    DEF 18.09
    dimethyl isosorbide 39.04
    tetrachloroethylene 20.95
    eugenol 20.74
    triacetin 28.17
    span 80 19.47
    1,4-butanediol 2.52
    1,1-dichloroethane 7.24
    2-methyl-1-pentanol 3.72
    methyl formate 9.98
    2-methyl-1-butanol 3.82
    n-decane 0.45
    butyronitrile 2.81
    3,7-dimethyl-1-octanol 4.11
    1-chlorooctane 3.2
    1-chlorotetradecane 0.78
    n-nonane 0.35
    undecane 0.26
    tert-butylcyclohexane 0.31
    cyclooctane 0.24
    cyclopentanol 6.95
    tetrahydropyran 13.15
    tert-amyl methyl ether 5.14
    2,5,8-trioxanonane 34.43
    1-hexene 0.91
    2-isopropoxyethanol 10.6
    2,2,2-trifluoroethanol 12.32
    methyl butyrate 10.11

    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