Isoabienol

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    10207-79-1

    Molecular formula
    C20H34O

    SMILES
    C[C@]12CCCC([C@@H]1CC[C@@]([C@@H]2CCC(=C)C=C)(C)O)(C)C

    Retention indicies (RI)

    • DB5: 2220.0

  • Odor profile

    Woody 86.07%
    Amber 47.51%
    Balsamic 41.15%
    Cedar 40.13%
    Sweet 39.51%
    Dry 39.38%
    Sandalwood 37.54%
    Spicy 33.19%
    Vetiver 32.27%
    Pine 29.29%

    Scent© AI

  • Properties

    XLogP3-AA
    6.5

    Molecular weight
    290.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    389°C

    Flash point est.
    142.05 ˚C

  • Synonyms

    • ISOABIENOL
    • 10207-79-1
    • (1R,2R,4aS,8aS)-2,5,5,8a-tetramethyl-1-(3-methylidenepent-4-enyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
    • CHEMBL2228954
    • SCHEMBL20640862
    • DTXSID201318543
    • AKOS030501903

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 247.84
    methanol 154.2
    isopropanol 213.28
    water 0.11
    ethyl acetate 353.26
    n-propanol 269.63
    acetone 289.07
    n-butanol 289.21
    acetonitrile 137.41
    DMF 502.12
    toluene 557.67
    isobutanol 211.54
    1,4-dioxane 847.37
    methyl acetate 208.98
    THF 1881.24
    2-butanone 325.7
    n-pentanol 149.25
    sec-butanol 180.48
    n-hexane 36.83
    ethylene glycol 7.7
    NMP 478.53
    cyclohexane 100.57
    DMSO 156.15
    n-butyl acetate 395.6
    n-octanol 125.32
    chloroform 622.99
    n-propyl acetate 208.91
    acetic acid 105.6
    dichloromethane 476.43
    cyclohexanone 622.58
    propylene glycol 26.24
    isopropyl acetate 326.6
    DMAc 383.73
    2-ethoxyethanol 151.25
    isopentanol 261.29
    n-heptane 52.32
    ethyl formate 130.61
    1,2-dichloroethane 291.69
    n-hexanol 324.78
    2-methoxyethanol 267.54
    isobutyl acetate 194.53
    tetrachloromethane 95.82
    n-pentyl acetate 265.4
    transcutol 1122.91
    n-heptanol 153.7
    ethylbenzene 164.09
    MIBK 296.5
    2-propoxyethanol 497.17
    tert-butanol 241.5
    MTBE 408.31
    2-butoxyethanol 254.42
    propionic acid 104.35
    o-xylene 211.91
    formic acid 23.89
    diethyl ether 532.67
    m-xylene 341.87
    p-xylene 192.39
    chlorobenzene 327.5
    dimethyl carbonate 131.11
    n-octane 13.76
    formamide 43.16
    cyclopentanone 714.12
    2-pentanone 371.34
    anisole 298.12
    cyclopentyl methyl ether 677.73
    gamma-butyrolactone 634.51
    1-methoxy-2-propanol 337.78
    pyridine 641.5
    3-pentanone 270.61
    furfural 435.28
    n-dodecane 7.46
    diethylene glycol 160.85
    diisopropyl ether 175.23
    tert-amyl alcohol 181.58
    acetylacetone 360.01
    n-hexadecane 9.3
    acetophenone 220.35
    methyl propionate 275.42
    isopentyl acetate 404.91
    trichloroethylene 559.02
    n-nonanol 119.1
    cyclohexanol 271.04
    benzyl alcohol 167.88
    2-ethylhexanol 199.39
    isooctanol 131.54
    dipropyl ether 363.67
    1,2-dichlorobenzene 252.02
    ethyl lactate 85.31
    propylene carbonate 308.25
    n-methylformamide 132.71
    2-pentanol 193.64
    n-pentane 52.72
    1-propoxy-2-propanol 448.27
    1-methoxy-2-propyl acetate 487.26
    2-(2-methoxypropoxy) propanol 269.95
    mesitylene 197.8
    ε-caprolactone 501.31
    p-cymene 136.5
    epichlorohydrin 700.9
    1,1,1-trichloroethane 307.03
    2-aminoethanol 46.91
    morpholine-4-carbaldehyde 578.8
    sulfolane 442.7
    2,2,4-trimethylpentane 28.72
    2-methyltetrahydrofuran 876.31
    n-hexyl acetate 340.68
    isooctane 28.66
    2-(2-butoxyethoxy)ethanol 368.28
    sec-butyl acetate 192.74
    tert-butyl acetate 378.31
    decalin 39.46
    glycerin 42.9
    diglyme 663.34
    acrylic acid 72.49
    isopropyl myristate 127.44
    n-butyric acid 252.49
    acetyl acetate 211.58
    di(2-ethylhexyl) phthalate 128.24
    ethyl propionate 201.34
    nitromethane 196.5
    1,2-diethoxyethane 451.6
    benzonitrile 243.33
    trioctyl phosphate 88.62
    1-bromopropane 282.14
    gamma-valerolactone 873.28
    n-decanol 80.17
    triethyl phosphate 123.23
    4-methyl-2-pentanol 143.32
    propionitrile 191.14
    vinylene carbonate 275.67
    1,1,2-trichlorotrifluoroethane 253.99
    DMS 219.93
    cumene 108.98
    2-octanol 94.2
    2-hexanone 215.41
    octyl acetate 151.37
    limonene 189.17
    1,2-dimethoxyethane 431.91
    ethyl orthosilicate 134.15
    tributyl phosphate 102.09
    diacetone alcohol 288.24
    N,N-dimethylaniline 213.38
    acrylonitrile 172.79
    aniline 325.18
    1,3-propanediol 111.35
    bromobenzene 370.25
    dibromomethane 326.86
    1,1,2,2-tetrachloroethane 445.34
    2-methyl-cyclohexyl acetate 253.66
    tetrabutyl urea 137.44
    diisobutyl methanol 129.29
    2-phenylethanol 273.63
    styrene 189.87
    dioctyl adipate 174.4
    dimethyl sulfate 153.35
    ethyl butyrate 275.95
    methyl lactate 107.35
    butyl lactate 185.35
    diethyl carbonate 161.98
    propanediol butyl ether 197.94
    triethyl orthoformate 236.23
    p-tert-butyltoluene 147.53
    methyl 4-tert-butylbenzoate 277.73
    morpholine 956.99
    tert-butylamine 194.77
    n-dodecanol 55.49
    dimethoxymethane 555.13
    ethylene carbonate 247.63
    cyrene 213.65
    2-ethoxyethyl acetate 355.4
    2-ethylhexyl acetate 325.15
    1,2,4-trichlorobenzene 306.42
    4-methylpyridine 658.58
    dibutyl ether 199.49
    2,6-dimethyl-4-heptanol 129.29
    DEF 351.58
    dimethyl isosorbide 563.18
    tetrachloroethylene 258.21
    eugenol 227.22
    triacetin 275.14
    span 80 250.34
    1,4-butanediol 27.97
    1,1-dichloroethane 296.79
    2-methyl-1-pentanol 151.93
    methyl formate 99.32
    2-methyl-1-butanol 229.24
    n-decane 18.52
    butyronitrile 255.35
    3,7-dimethyl-1-octanol 148.99
    1-chlorooctane 97.95
    1-chlorotetradecane 29.0
    n-nonane 17.25
    undecane 11.18
    tert-butylcyclohexane 36.97
    cyclooctane 36.76
    cyclopentanol 230.63
    tetrahydropyran 1024.23
    tert-amyl methyl ether 274.34
    2,5,8-trioxanonane 406.56
    1-hexene 128.91
    2-isopropoxyethanol 148.92
    2,2,2-trifluoroethanol 38.04
    methyl butyrate 234.64

    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
Clary sage (Hungary) 1b 8016-63-5 Salvia sclarea L., fam. Lamiaceae (Labiatae) 3.0%
Juniperus cedrus (Portugal-Madeira) Juniperus cedrus Webb & Berth. (J. oxycedrus L), fam. Cupressaceae 1.0%