Chrysanthenyl angelate

  • Identifiers

    Molecular formula
    C15H22O2

    SMILES
    C/C=C(/C)\C(=O)OC1C2CC=C(C1C2(C)C)C

    Retention indicies (RI)

    • DB5: 1537.0
  • Odor profile

    Herbal 72.2%
    Fruity 65.76%
    Woody 60.09%
    Sweet 51.74%
    Mint 50.98%
    Spicy 47.15%
    Floral 41.21%
    Fresh 36.13%
    Pine 35.33%
    Camphoreous 34.84%

    Scent© AI

  • Properties

    XLogP3-AA
    3.5

    Molecular weight
    234.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    273°C

    Flash point est.
    114.1 ˚C

  • Synonyms

    • Chrysanthenyl angelate
    • XBIYGXBPWHLVBE-TWGQIWQCSA-N
  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 581.31
    methanol 440.49
    isopropanol 551.88
    water 2.48
    ethyl acetate 896.71
    n-propanol 544.68
    acetone 822.84
    n-butanol 583.37
    acetonitrile 541.61
    DMF 1019.28
    toluene 812.57
    isobutanol 507.98
    1,4-dioxane 1542.28
    methyl acetate 771.22
    THF 1675.25
    2-butanone 807.76
    n-pentanol 352.87
    sec-butanol 524.62
    n-hexane 100.88
    ethylene glycol 81.63
    NMP 939.79
    cyclohexane 237.4
    DMSO 376.8
    n-butyl acetate 700.44
    n-octanol 232.56
    chloroform 2576.39
    n-propyl acetate 473.37
    acetic acid 701.85
    dichloromethane 1791.46
    cyclohexanone 1149.58
    propylene glycol 148.94
    isopropyl acetate 706.78
    DMAc 856.24
    2-ethoxyethanol 467.09
    isopentanol 623.39
    n-heptane 51.02
    ethyl formate 422.56
    1,2-dichloroethane 1309.46
    n-hexanol 583.68
    2-methoxyethanol 746.51
    isobutyl acetate 382.44
    tetrachloromethane 413.31
    n-pentyl acetate 410.74
    transcutol 1860.59
    n-heptanol 257.37
    ethylbenzene 387.33
    MIBK 588.45
    2-propoxyethanol 858.48
    tert-butanol 700.08
    MTBE 975.82
    2-butoxyethanol 490.87
    propionic acid 460.03
    o-xylene 463.51
    formic acid 253.62
    diethyl ether 949.58
    m-xylene 632.15
    p-xylene 551.81
    chlorobenzene 921.04
    dimethyl carbonate 373.4
    n-octane 23.92
    formamide 434.89
    cyclopentanone 1091.21
    2-pentanone 736.47
    anisole 621.99
    cyclopentyl methyl ether 961.92
    gamma-butyrolactone 1114.46
    1-methoxy-2-propanol 670.88
    pyridine 1180.8
    3-pentanone 609.8
    furfural 991.68
    n-dodecane 20.67
    diethylene glycol 516.94
    diisopropyl ether 415.35
    tert-amyl alcohol 597.05
    acetylacetone 815.28
    n-hexadecane 25.27
    acetophenone 528.57
    methyl propionate 653.9
    isopentyl acetate 750.47
    trichloroethylene 2395.46
    n-nonanol 222.69
    cyclohexanol 644.75
    benzyl alcohol 424.04
    2-ethylhexanol 326.92
    isooctanol 229.13
    dipropyl ether 342.28
    1,2-dichlorobenzene 796.22
    ethyl lactate 208.96
    propylene carbonate 726.46
    n-methylformamide 493.81
    2-pentanol 515.6
    n-pentane 120.54
    1-propoxy-2-propanol 550.69
    1-methoxy-2-propyl acetate 778.77
    2-(2-methoxypropoxy) propanol 453.82
    mesitylene 403.96
    ε-caprolactone 1018.92
    p-cymene 201.16
    epichlorohydrin 1516.99
    1,1,1-trichloroethane 1355.93
    2-aminoethanol 231.75
    morpholine-4-carbaldehyde 1109.25
    sulfolane 818.61
    2,2,4-trimethylpentane 82.0
    2-methyltetrahydrofuran 1304.72
    n-hexyl acetate 582.98
    isooctane 77.41
    2-(2-butoxyethoxy)ethanol 627.27
    sec-butyl acetate 454.99
    tert-butyl acetate 771.39
    decalin 119.74
    glycerin 202.34
    diglyme 1049.98
    acrylic acid 409.69
    isopropyl myristate 218.22
    n-butyric acid 688.56
    acetyl acetate 665.08
    di(2-ethylhexyl) phthalate 207.29
    ethyl propionate 465.97
    nitromethane 1002.59
    1,2-diethoxyethane 739.6
    benzonitrile 599.54
    trioctyl phosphate 143.27
    1-bromopropane 765.24
    gamma-valerolactone 1384.87
    n-decanol 157.09
    triethyl phosphate 210.2
    4-methyl-2-pentanol 391.75
    propionitrile 487.41
    vinylene carbonate 715.85
    1,1,2-trichlorotrifluoroethane 814.73
    DMS 580.0
    cumene 268.54
    2-octanol 185.09
    2-hexanone 468.84
    octyl acetate 269.23
    limonene 266.32
    1,2-dimethoxyethane 873.1
    ethyl orthosilicate 216.62
    tributyl phosphate 189.17
    diacetone alcohol 617.19
    N,N-dimethylaniline 402.7
    acrylonitrile 535.43
    aniline 709.26
    1,3-propanediol 418.85
    bromobenzene 985.55
    dibromomethane 1181.12
    1,1,2,2-tetrachloroethane 1933.25
    2-methyl-cyclohexyl acetate 382.47
    tetrabutyl urea 212.1
    diisobutyl methanol 199.85
    2-phenylethanol 560.94
    styrene 439.34
    dioctyl adipate 274.91
    dimethyl sulfate 432.16
    ethyl butyrate 417.35
    methyl lactate 292.71
    butyl lactate 294.38
    diethyl carbonate 301.53
    propanediol butyl ether 351.77
    triethyl orthoformate 321.55
    p-tert-butyltoluene 201.88
    methyl 4-tert-butylbenzoate 420.85
    morpholine 1625.32
    tert-butylamine 505.29
    n-dodecanol 114.69
    dimethoxymethane 786.9
    ethylene carbonate 612.78
    cyrene 353.11
    2-ethoxyethyl acetate 646.49
    2-ethylhexyl acetate 604.86
    1,2,4-trichlorobenzene 887.39
    4-methylpyridine 1308.98
    dibutyl ether 310.95
    2,6-dimethyl-4-heptanol 199.85
    DEF 803.36
    dimethyl isosorbide 721.27
    tetrachloroethylene 1240.67
    eugenol 376.15
    triacetin 490.55
    span 80 360.7
    1,4-butanediol 141.94
    1,1-dichloroethane 1395.8
    2-methyl-1-pentanol 420.93
    methyl formate 384.4
    2-methyl-1-butanol 584.87
    n-decane 36.77
    butyronitrile 541.53
    3,7-dimethyl-1-octanol 277.58
    1-chlorooctane 180.34
    1-chlorotetradecane 73.3
    n-nonane 31.14
    undecane 26.78
    tert-butylcyclohexane 100.04
    cyclooctane 89.85
    cyclopentanol 572.42
    tetrahydropyran 1441.73
    tert-amyl methyl ether 630.15
    2,5,8-trioxanonane 636.61
    1-hexene 296.38
    2-isopropoxyethanol 403.66
    2,2,2-trifluoroethanol 331.21
    methyl butyrate 531.66

    Scent© AI

1 of 4
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
Name CAS Botanical Proportion
Tanacetum parthenium (The Netherlands) Tanacetum parthenium (L.) Schultz-Bip. (Feverfew), Asteraceae (Compositae) 0.01%