Ipsdienone

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    539-70-8

    Molecular formula
    C10H14O

    SMILES
    CC(=CC(=O)CC(=C)C=C)C

    Retention indicies (RI)

    • DB5: 1148.0

  • Odor profile

    Fruity 50.19%
    Green 49.6%
    Herbal 47.08%
    Mint 46.4%
    Sweet 44.84%
    Spicy 40.61%
    Citrus 33.58%
    Metallic 33.44%
    Fresh 32.29%
    Pungent 32.07%

    Scent© AI

  • Properties

    XLogP3-AA
    3.2

    Molecular weight
    150.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately fast

    Boiling point est.
    203°C

    Flash point est.
    69.1 ˚C

  • Synonyms

    • ipsdienone
    • Myrcenone
    • myrcenon
    • 539-70-8
    • 2-methyl-6-methylideneocta-2,7-dien-4-one
    • 2-methyl-6-methylene-2,7-octadien-4-one
    • 2,7-Octadien-4-one, 2-methyl-6-methylene-
    • 2-Methyl-6-methyleneocta-2,7-dien-4-one
    • CHEBI:84966
    • DTXSID70424017
    • SCHEMBL2167142
    • DTXCID60374855
    • C20944
    • Q27158228

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 458.88
    methanol 570.34
    isopropanol 362.06
    water 2.7
    ethyl acetate 200.23
    n-propanol 355.59
    acetone 262.11
    n-butanol 389.21
    acetonitrile 222.87
    DMF 397.76
    toluene 136.98
    isobutanol 277.05
    1,4-dioxane 510.5
    methyl acetate 200.75
    THF 644.61
    2-butanone 238.73
    n-pentanol 252.52
    sec-butanol 338.08
    n-hexane 197.62
    ethylene glycol 88.29
    NMP 410.91
    cyclohexane 210.51
    DMSO 201.75
    n-butyl acetate 223.76
    n-octanol 201.44
    chloroform 611.18
    n-propyl acetate 138.26
    acetic acid 330.36
    dichloromethane 326.22
    cyclohexanone 422.88
    propylene glycol 165.14
    isopropyl acetate 138.35
    DMAc 369.88
    2-ethoxyethanol 214.8
    isopentanol 297.15
    n-heptane 115.44
    ethyl formate 162.49
    1,2-dichloroethane 192.46
    n-hexanol 490.61
    2-methoxyethanol 389.5
    isobutyl acetate 110.85
    tetrachloromethane 110.49
    n-pentyl acetate 129.81
    transcutol 666.09
    n-heptanol 178.6
    ethylbenzene 112.62
    MIBK 154.5
    2-propoxyethanol 435.75
    tert-butanol 444.27
    MTBE 290.14
    2-butoxyethanol 213.8
    propionic acid 249.4
    o-xylene 115.61
    formic acid 117.05
    diethyl ether 270.07
    m-xylene 120.19
    p-xylene 143.05
    chlorobenzene 173.84
    dimethyl carbonate 78.22
    n-octane 36.83
    formamide 98.4
    cyclopentanone 342.41
    2-pentanone 208.48
    anisole 177.46
    cyclopentyl methyl ether 310.58
    gamma-butyrolactone 346.64
    1-methoxy-2-propanol 308.31
    pyridine 280.74
    3-pentanone 160.1
    furfural 310.03
    n-dodecane 29.53
    diethylene glycol 252.06
    diisopropyl ether 98.62
    tert-amyl alcohol 382.74
    acetylacetone 180.36
    n-hexadecane 32.02
    acetophenone 154.84
    methyl propionate 158.56
    isopentyl acetate 208.72
    trichloroethylene 373.93
    n-nonanol 175.73
    cyclohexanol 372.83
    benzyl alcohol 162.76
    2-ethylhexanol 245.15
    isooctanol 134.42
    dipropyl ether 221.0
    1,2-dichlorobenzene 162.91
    ethyl lactate 106.2
    propylene carbonate 251.08
    n-methylformamide 175.91
    2-pentanol 266.04
    n-pentane 141.88
    1-propoxy-2-propanol 323.74
    1-methoxy-2-propyl acetate 201.89
    2-(2-methoxypropoxy) propanol 233.03
    mesitylene 85.39
    ε-caprolactone 324.1
    p-cymene 93.27
    epichlorohydrin 322.06
    1,1,1-trichloroethane 265.74
    2-aminoethanol 193.87
    morpholine-4-carbaldehyde 383.64
    sulfolane 326.49
    2,2,4-trimethylpentane 58.98
    2-methyltetrahydrofuran 481.32
    n-hexyl acetate 244.82
    isooctane 45.21
    2-(2-butoxyethoxy)ethanol 304.73
    sec-butyl acetate 109.7
    tert-butyl acetate 170.74
    decalin 79.19
    glycerin 178.67
    diglyme 407.27
    acrylic acid 185.78
    isopropyl myristate 113.26
    n-butyric acid 356.28
    acetyl acetate 134.61
    di(2-ethylhexyl) phthalate 114.33
    ethyl propionate 130.55
    nitromethane 279.42
    1,2-diethoxyethane 220.43
    benzonitrile 191.61
    trioctyl phosphate 87.24
    1-bromopropane 195.18
    gamma-valerolactone 445.56
    n-decanol 135.71
    triethyl phosphate 100.76
    4-methyl-2-pentanol 152.93
    propionitrile 206.93
    vinylene carbonate 219.18
    1,1,2-trichlorotrifluoroethane 290.0
    DMS 152.89
    cumene 89.85
    2-octanol 125.31
    2-hexanone 172.69
    octyl acetate 146.69
    limonene 149.51
    1,2-dimethoxyethane 390.47
    ethyl orthosilicate 105.55
    tributyl phosphate 107.25
    diacetone alcohol 216.01
    N,N-dimethylaniline 147.4
    acrylonitrile 187.52
    aniline 179.77
    1,3-propanediol 261.62
    bromobenzene 150.41
    dibromomethane 273.44
    1,1,2,2-tetrachloroethane 378.92
    2-methyl-cyclohexyl acetate 167.19
    tetrabutyl urea 136.93
    diisobutyl methanol 132.16
    2-phenylethanol 209.81
    styrene 119.2
    dioctyl adipate 150.33
    dimethyl sulfate 101.84
    ethyl butyrate 160.75
    methyl lactate 114.95
    butyl lactate 138.22
    diethyl carbonate 128.61
    propanediol butyl ether 234.47
    triethyl orthoformate 143.14
    p-tert-butyltoluene 92.88
    methyl 4-tert-butylbenzoate 173.69
    morpholine 574.71
    tert-butylamine 329.13
    n-dodecanol 105.75
    dimethoxymethane 220.57
    ethylene carbonate 193.6
    cyrene 188.42
    2-ethoxyethyl acetate 149.25
    2-ethylhexyl acetate 166.52
    1,2,4-trichlorobenzene 181.59
    4-methylpyridine 297.6
    dibutyl ether 188.19
    2,6-dimethyl-4-heptanol 132.16
    DEF 229.19
    dimethyl isosorbide 326.61
    tetrachloroethylene 238.8
    eugenol 177.4
    triacetin 187.5
    span 80 253.09
    1,4-butanediol 109.24
    1,1-dichloroethane 252.84
    2-methyl-1-pentanol 230.11
    methyl formate 138.36
    2-methyl-1-butanol 284.44
    n-decane 46.43
    butyronitrile 273.61
    3,7-dimethyl-1-octanol 183.38
    1-chlorooctane 118.33
    1-chlorotetradecane 60.36
    n-nonane 48.24
    undecane 35.56
    tert-butylcyclohexane 75.6
    cyclooctane 69.27
    cyclopentanol 320.28
    tetrahydropyran 563.79
    tert-amyl methyl ether 236.33
    2,5,8-trioxanonane 299.87
    1-hexene 281.77
    2-isopropoxyethanol 162.92
    2,2,2-trifluoroethanol 102.23
    methyl butyrate 178.84

    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

Botanical

Name CAS Botanical Proportion
Hyptis mutabilis Hyptis mutabilis (Rich.) Briq., fam. Lamiaceae (Labiatae) 14.85%
Tansy (France) 8016-87-3 Tanacetum vulgare L., fam. Asteraceae (compositae) 1.2%