Scentenal

Overview IFRA Request a quote

  • Identifiers

    CAS number
    86803-90-9

    Molecular formula
    C12H18O2

    SMILES
    COC1CC2CC1C3C2CC(C3)C=O

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Floral 72.68%
    Woody 60.75%
    Fresh 53.94%
    Green 51.94%
    Aldehydic 48.44%
    Herbal 42.32%
    Muguet 35.62%
    Ozone 34.9%
    Fruity 33.47%
    Lily 31.15%

    Scent© AI

  • Properties

    XLogP3-AA
    1.4

    Molecular weight
    194.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    295°C

    Flash point est.
    102.22 ˚C

  • Synonyms

    • Scentenal
    • 86803-90-9
    • Octahydro-5-methoxy-4,7-methano-1(H)-indene-2-carboxaldehyde
    • AUK25Q8UTG
    • 4,7-Methano-1H-indene-2-carboxaldehyde, octahydro-5-methoxy-
    • 8-methoxytricyclo[5.2.1.02,6]decane-4-carbaldehyde
    • 6-Methoxy dicyclopentadiene carboxaldehyde
    • Octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde
    • 8-Methoxytricyclo(5.2.2.1)decane-4-carboxaldehyde
    • 5-METHOXYOCTAHYDRO-1H-4,7-METHANOINDENE-2-CARBOXALDEHYDE
    • SCENTENAL(R)
    • UNII-AUK25Q8UTG
    • SCHEMBL230817
    • DTXSID6052586
    • UOGMZEGKCNHMBF-UHFFFAOYSA-N
    • 6-methoxydicyclopentadienecarboxaldehyde
    • NS00013190
    • 5-Methoxyoctahydro-1H-4,7-methanoindene-2-carbaldehyde
    • 429-860-9
    • 617-923-5

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1034.12
    methanol 1719.35
    isopropanol 1141.03
    water 32.19
    ethyl acetate 1269.54
    n-propanol 811.28
    acetone 1432.92
    n-butanol 845.19
    acetonitrile 1453.46
    DMF 871.62
    toluene 611.93
    isobutanol 594.45
    1,4-dioxane 2103.88
    methyl acetate 887.73
    THF 2003.93
    2-butanone 773.42
    n-pentanol 278.08
    sec-butanol 400.78
    n-hexane 14.09
    ethylene glycol 346.75
    NMP 330.3
    cyclohexane 81.66
    DMSO 740.58
    n-butyl acetate 464.67
    n-octanol 116.24
    chloroform 3781.22
    n-propyl acetate 409.76
    acetic acid 1238.34
    dichloromethane 2963.51
    cyclohexanone 955.9
    propylene glycol 292.43
    isopropyl acetate 815.95
    DMAc 375.39
    2-ethoxyethanol 690.11
    isopentanol 709.22
    n-heptane 19.57
    ethyl formate 990.61
    1,2-dichloroethane 1472.75
    n-hexanol 332.5
    2-methoxyethanol 1586.17
    isobutyl acetate 293.07
    tetrachloromethane 521.51
    n-pentyl acetate 212.42
    transcutol 1759.71
    n-heptanol 141.7
    ethylbenzene 169.99
    MIBK 549.47
    2-propoxyethanol 786.73
    tert-butanol 953.21
    MTBE 553.87
    2-butoxyethanol 366.99
    propionic acid 630.69
    o-xylene 267.56
    formic acid 648.96
    diethyl ether 752.9
    m-xylene 381.53
    p-xylene 234.87
    chlorobenzene 819.1
    dimethyl carbonate 380.22
    n-octane 11.08
    formamide 874.8
    cyclopentanone 1142.61
    2-pentanone 756.06
    anisole 427.74
    cyclopentyl methyl ether 619.33
    gamma-butyrolactone 1376.85
    1-methoxy-2-propanol 1091.47
    pyridine 1317.14
    3-pentanone 409.33
    furfural 1291.63
    n-dodecane 11.77
    diethylene glycol 811.7
    diisopropyl ether 209.76
    tert-amyl alcohol 321.36
    acetylacetone 1010.5
    n-hexadecane 13.57
    acetophenone 341.37
    methyl propionate 619.74
    isopentyl acetate 422.68
    trichloroethylene 2584.66
    n-nonanol 105.28
    cyclohexanol 549.28
    benzyl alcohol 381.61
    2-ethylhexanol 151.53
    isooctanol 121.89
    dipropyl ether 195.79
    1,2-dichlorobenzene 618.28
    ethyl lactate 219.62
    propylene carbonate 891.07
    n-methylformamide 1021.99
    2-pentanol 419.83
    n-pentane 34.19
    1-propoxy-2-propanol 439.78
    1-methoxy-2-propyl acetate 568.11
    2-(2-methoxypropoxy) propanol 261.69
    mesitylene 229.39
    ε-caprolactone 745.69
    p-cymene 115.05
    epichlorohydrin 1791.4
    1,1,1-trichloroethane 1436.14
    2-aminoethanol 507.82
    morpholine-4-carbaldehyde 817.45
    sulfolane 706.9
    2,2,4-trimethylpentane 22.44
    2-methyltetrahydrofuran 906.04
    n-hexyl acetate 266.78
    isooctane 30.01
    2-(2-butoxyethoxy)ethanol 405.81
    sec-butyl acetate 302.16
    tert-butyl acetate 588.49
    decalin 30.11
    glycerin 471.79
    diglyme 904.79
    acrylic acid 591.54
    isopropyl myristate 108.38
    n-butyric acid 1234.95
    acetyl acetate 893.18
    di(2-ethylhexyl) phthalate 116.13
    ethyl propionate 356.61
    nitromethane 1866.84
    1,2-diethoxyethane 526.3
    benzonitrile 648.78
    trioctyl phosphate 77.19
    1-bromopropane 602.23
    gamma-valerolactone 1494.63
    n-decanol 79.2
    triethyl phosphate 125.28
    4-methyl-2-pentanol 285.65
    propionitrile 944.77
    vinylene carbonate 983.92
    1,1,2-trichlorotrifluoroethane 937.78
    DMS 300.73
    cumene 117.86
    2-octanol 83.01
    2-hexanone 299.64
    octyl acetate 120.95
    limonene 130.46
    1,2-dimethoxyethane 965.13
    ethyl orthosilicate 126.72
    tributyl phosphate 102.38
    diacetone alcohol 502.18
    N,N-dimethylaniline 198.02
    acrylonitrile 1199.09
    aniline 740.62
    1,3-propanediol 992.19
    bromobenzene 863.49
    dibromomethane 1643.58
    1,1,2,2-tetrachloroethane 1749.47
    2-methyl-cyclohexyl acetate 193.94
    tetrabutyl urea 104.99
    diisobutyl methanol 132.75
    2-phenylethanol 359.52
    styrene 222.61
    dioctyl adipate 142.38
    dimethyl sulfate 356.75
    ethyl butyrate 324.39
    methyl lactate 366.57
    butyl lactate 183.96
    diethyl carbonate 240.49
    propanediol butyl ether 266.23
    triethyl orthoformate 210.28
    p-tert-butyltoluene 113.64
    methyl 4-tert-butylbenzoate 245.03
    morpholine 1584.98
    tert-butylamine 505.38
    n-dodecanol 62.43
    dimethoxymethane 1022.18
    ethylene carbonate 919.69
    cyrene 230.59
    2-ethoxyethyl acetate 401.45
    2-ethylhexyl acetate 263.12
    1,2,4-trichlorobenzene 604.71
    4-methylpyridine 1067.32
    dibutyl ether 147.05
    2,6-dimethyl-4-heptanol 132.75
    DEF 459.11
    dimethyl isosorbide 417.79
    tetrachloroethylene 1227.66
    eugenol 247.74
    triacetin 301.68
    span 80 203.04
    1,4-butanediol 277.05
    1,1-dichloroethane 1733.99
    2-methyl-1-pentanol 232.33
    methyl formate 941.75
    2-methyl-1-butanol 410.26
    n-decane 18.36
    butyronitrile 992.43
    3,7-dimethyl-1-octanol 139.4
    1-chlorooctane 81.89
    1-chlorotetradecane 36.6
    n-nonane 15.84
    undecane 14.21
    tert-butylcyclohexane 27.22
    cyclooctane 28.87
    cyclopentanol 554.97
    tetrahydropyran 1209.39
    tert-amyl methyl ether 231.53
    2,5,8-trioxanonane 490.69
    1-hexene 74.67
    2-isopropoxyethanol 419.87
    2,2,2-trifluoroethanol 662.18
    methyl butyrate 461.27

    Scent© AI

1 4

IFRA standard 51

Recommendation
Restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 0.19 % Category 7A
Rinse-off products applied to the hair with some hand contact
 2.2 %
Category 2
Products applied to the axillae
 0.057 % Category 7B
Leave-on products applied to the hair with some hand contact
 2.2 %
Category 3
Products applied to the face/body using fingertips
 1.2 % Category 8
Products with significant anogenital exposure
 0.091 %
Category 4
Products related to fine fragrance
 1.1 % Category 9
Products with body and hand exposure, primarily rinse off
 2.1 %
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 0.27 % Category 10A
Household care products with mostly hand contact
 2.1 %
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 0.27 % Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 7.5 %
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 0.27 % Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 0.091 %
Category 5D
Baby Creams, baby Oils and baby talc
 0.091 % Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 0.091 %
Category 6
Products with oral and lip exposure
 0.63 % Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction