CID 5317424

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    19912-61-9

    Molecular formula
    C15H20O

    SMILES
    C/C/1=C/CC2=C(C/C(=C\CC1)/C)OC=C2C

    Retention indicies (RI)

    • DB5: 1646.0

  • Odor profile

    Herbal 48.93%
    Woody 48.36%
    Spicy 46.3%
    Tobacco 40.32%
    Mint 37.73%
    Citrus 36.08%
    Earthy 34.65%
    Phenolic 32.12%
    Musty 29.59%
    Animal 29.58%

    Scent© AI

  • Properties

    XLogP3-AA
    3.7

    Molecular weight
    216.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    339°C

    Flash point est.
    131.27 ˚C

  • Synonyms

    • Isofuranodiene
    • Furanodiene
    • 19912-61-9
    • (5Z,9Z)-3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan
    • UNII-7E7DKT38LE
    • 57566-47-9
    • 7E7DKT38LE
    • Cyclodeca(b)furan, 4,7,8,11-tetrahydro-3,6,10-trimethyl-, (E,E)-
    • UNII-G0AFT38FJ7
    • DA-53440
    • DA-54420
    • 1ST170878
    • 3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca-[b]-furan
    • (3Z,7Z)-3,7,11-Trimethyl-13-Oxabicyclo[8.3.0]Trideca-3,7,11,14-Tetraene

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 201.11
    methanol 145.21
    isopropanol 145.51
    water 0.26
    ethyl acetate 293.63
    n-propanol 193.96
    acetone 224.51
    n-butanol 213.81
    acetonitrile 160.24
    DMF 257.83
    toluene 492.32
    isobutanol 174.21
    1,4-dioxane 784.1
    methyl acetate 254.29
    THF 803.36
    2-butanone 321.91
    n-pentanol 190.54
    sec-butanol 177.62
    n-hexane 52.95
    ethylene glycol 23.56
    NMP 249.88
    cyclohexane 146.82
    DMSO 152.3
    n-butyl acetate 334.19
    n-octanol 155.63
    chloroform 1451.06
    n-propyl acetate 222.39
    acetic acid 121.91
    dichloromethane 1154.18
    cyclohexanone 476.96
    propylene glycol 56.54
    isopropyl acetate 194.73
    DMAc 337.89
    2-ethoxyethanol 205.56
    isopentanol 208.53
    n-heptane 66.95
    ethyl formate 192.62
    1,2-dichloroethane 472.14
    n-hexanol 264.87
    2-methoxyethanol 237.66
    isobutyl acetate 205.4
    tetrachloromethane 204.83
    n-pentyl acetate 215.77
    transcutol 912.62
    n-heptanol 155.73
    ethylbenzene 257.42
    MIBK 179.75
    2-propoxyethanol 308.71
    tert-butanol 183.28
    MTBE 245.04
    2-butoxyethanol 224.92
    propionic acid 118.46
    o-xylene 246.06
    formic acid 28.21
    diethyl ether 271.81
    m-xylene 280.72
    p-xylene 347.2
    chlorobenzene 421.27
    dimethyl carbonate 90.98
    n-octane 32.4
    formamide 57.38
    cyclopentanone 420.9
    2-pentanone 245.25
    anisole 349.85
    cyclopentyl methyl ether 337.71
    gamma-butyrolactone 342.76
    1-methoxy-2-propanol 189.01
    pyridine 712.65
    3-pentanone 225.52
    furfural 371.33
    n-dodecane 30.53
    diethylene glycol 152.94
    diisopropyl ether 99.96
    tert-amyl alcohol 191.24
    acetylacetone 242.59
    n-hexadecane 35.29
    acetophenone 290.03
    methyl propionate 204.68
    isopentyl acetate 318.06
    trichloroethylene 979.49
    n-nonanol 153.63
    cyclohexanol 244.02
    benzyl alcohol 263.87
    2-ethylhexanol 203.95
    isooctanol 135.91
    dipropyl ether 237.19
    1,2-dichlorobenzene 335.52
    ethyl lactate 92.4
    propylene carbonate 266.41
    n-methylformamide 108.82
    2-pentanol 148.55
    n-pentane 50.79
    1-propoxy-2-propanol 243.33
    1-methoxy-2-propyl acetate 282.34
    2-(2-methoxypropoxy) propanol 269.1
    mesitylene 159.96
    ε-caprolactone 369.33
    p-cymene 174.45
    epichlorohydrin 531.14
    1,1,1-trichloroethane 487.87
    2-aminoethanol 67.88
    morpholine-4-carbaldehyde 362.22
    sulfolane 263.06
    2,2,4-trimethylpentane 38.12
    2-methyltetrahydrofuran 543.99
    n-hexyl acetate 298.44
    isooctane 28.14
    2-(2-butoxyethoxy)ethanol 342.15
    sec-butyl acetate 189.08
    tert-butyl acetate 197.67
    decalin 80.07
    glycerin 62.2
    diglyme 600.37
    acrylic acid 91.4
    isopropyl myristate 155.76
    n-butyric acid 220.03
    acetyl acetate 188.94
    di(2-ethylhexyl) phthalate 169.12
    ethyl propionate 185.16
    nitromethane 176.0
    1,2-diethoxyethane 436.4
    benzonitrile 320.53
    trioctyl phosphate 101.24
    1-bromopropane 372.91
    gamma-valerolactone 489.94
    n-decanol 120.53
    triethyl phosphate 120.47
    4-methyl-2-pentanol 108.44
    propionitrile 191.95
    vinylene carbonate 274.29
    1,1,2-trichlorotrifluoroethane 266.15
    DMS 206.56
    cumene 177.64
    2-octanol 116.13
    2-hexanone 242.78
    octyl acetate 182.11
    limonene 206.07
    1,2-dimethoxyethane 478.72
    ethyl orthosilicate 132.27
    tributyl phosphate 120.15
    diacetone alcohol 174.22
    N,N-dimethylaniline 248.33
    acrylonitrile 199.9
    aniline 338.24
    1,3-propanediol 116.96
    bromobenzene 507.07
    dibromomethane 807.3
    1,1,2,2-tetrachloroethane 746.18
    2-methyl-cyclohexyl acetate 252.1
    tetrabutyl urea 153.57
    diisobutyl methanol 115.13
    2-phenylethanol 289.88
    styrene 309.15
    dioctyl adipate 216.5
    dimethyl sulfate 94.38
    ethyl butyrate 242.09
    methyl lactate 77.07
    butyl lactate 148.21
    diethyl carbonate 169.55
    propanediol butyl ether 189.08
    triethyl orthoformate 188.68
    p-tert-butyltoluene 159.24
    methyl 4-tert-butylbenzoate 242.77
    morpholine 711.43
    tert-butylamine 151.27
    n-dodecanol 100.59
    dimethoxymethane 246.62
    ethylene carbonate 229.78
    cyrene 216.16
    2-ethoxyethyl acetate 295.54
    2-ethylhexyl acetate 286.04
    1,2,4-trichlorobenzene 392.2
    4-methylpyridine 607.37
    dibutyl ether 219.56
    2,6-dimethyl-4-heptanol 115.13
    DEF 245.18
    dimethyl isosorbide 420.26
    tetrachloroethylene 489.77
    eugenol 237.47
    triacetin 258.37
    span 80 250.47
    1,4-butanediol 66.46
    1,1-dichloroethane 460.95
    2-methyl-1-pentanol 221.81
    methyl formate 89.54
    2-methyl-1-butanol 210.38
    n-decane 48.32
    butyronitrile 235.65
    3,7-dimethyl-1-octanol 165.1
    1-chlorooctane 138.78
    1-chlorotetradecane 73.13
    n-nonane 43.88
    undecane 37.19
    tert-butylcyclohexane 65.91
    cyclooctane 51.19
    cyclopentanol 194.4
    tetrahydropyran 674.07
    tert-amyl methyl ether 197.32
    2,5,8-trioxanonane 428.25
    1-hexene 191.75
    2-isopropoxyethanol 173.99
    2,2,2-trifluoroethanol 41.74
    methyl butyrate 246.05

    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
Eugenia uniflora leaf (Brazil) 1 Eugenia uniflora L. (E. michelii Lam., E. pitanga (Berg), fam. Myrtaceae 0.96%
Protium heptaphyllum 2a leaf Protium heptaphyllum (Aubl.) March., fam. Burseraceae 2.2%
Pepper, black (Sao Tome) 8006-82-4 Piper nigrum L., fam. Piperaceae 2.1%
Hedyosmum mexicanum (Costa Rica) 1a leaf Hedyosmum mexicanum Cordemoy, fam. Chloranthaceae 25.0%
Hedyosmum mexicanum (Costa Rica) 1b fruit Hedyosmum mexicanum Cordemoy, fam. Chloranthaceae 15.0%
Hedyosmum costaricensis (Costa Rica) Hedyosmum costaricensis C.E. Wood, fam. Chloranthaceae 0.05%