(+/-) trans-3,3-Dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol

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  • Identifiers

    CAS number
    107898-54-4

    Molecular formula
    C15H26O

    SMILES
    CC1=CCC(C1(C)C)/C=C/C(C)(C)C(C)O

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Woody 87.18%
    Sandalwood 52.89%
    Herbal 49.49%
    Vetiver 41.05%
    Amber 39.82%
    Dry 38.39%
    Balsamic 34.56%
    Pine 33.55%
    Spicy 32.9%
    Cedar 31.79%

    Scent© AI

  • Properties

    XLogP3-AA
    3.8

    Molecular weight
    222.37 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    275°C

    Flash point est.
    117.06 ˚C

  • Synonyms

    • 107898-54-4
    • 3,3-DIMETHYL-5-(2,2,3-TRIMETHYL-3-CYCLOPENTEN-1-YL)-4-PENTEN-2-OL
    • 4-Penten-2-ol, 3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
    • EC 411-580-3
    • (E)-3,3-dimethyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-ol
    • (+/-) trans-3,3-dimethyl-5-(2,2,3-trimethyl-cyclopent-3-en-1-yl)pent-4-en-2-ol
    • 244626-73-1
    • DTXSID7051551
    • SCHEMBL238074
    • DTXCID1030103
    • QZFSNJAQFWEXEA-MDZDMXLPSA-N
    • DTXSID401021085
    • AKOS015900947
    • NS00077606
    • 4-aPenten-a2-aol, 3,a3-adimethyl-a5-a(2,a2,a3-atrimethyl-a3-acyclopenten-a1-ayl)a-a, (4E)a-
    • 411-580-3
    • 600-853-4
    • Polysantol

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 378.25
    methanol 265.18
    isopropanol 372.0
    water 1.77
    ethyl acetate 742.13
    n-propanol 345.83
    acetone 441.03
    n-butanol 377.29
    acetonitrile 361.69
    DMF 551.9
    toluene 600.89
    isobutanol 266.3
    1,4-dioxane 1134.23
    methyl acetate 546.33
    THF 1202.05
    2-butanone 535.89
    n-pentanol 245.4
    sec-butanol 377.75
    n-hexane 163.84
    ethylene glycol 43.84
    NMP 392.39
    cyclohexane 214.88
    DMSO 277.93
    n-butyl acetate 498.74
    n-octanol 213.5
    chloroform 1255.92
    n-propyl acetate 375.35
    acetic acid 237.27
    dichloromethane 827.21
    cyclohexanone 541.47
    propylene glycol 105.35
    isopropyl acetate 623.99
    DMAc 684.7
    2-ethoxyethanol 379.9
    isopentanol 377.04
    n-heptane 114.42
    ethyl formate 256.49
    1,2-dichloroethane 489.19
    n-hexanol 419.26
    2-methoxyethanol 509.54
    isobutyl acetate 304.09
    tetrachloromethane 352.24
    n-pentyl acetate 321.68
    transcutol 1546.38
    n-heptanol 243.53
    ethylbenzene 420.31
    MIBK 425.69
    2-propoxyethanol 592.47
    tert-butanol 595.31
    MTBE 988.32
    2-butoxyethanol 413.26
    propionic acid 233.92
    o-xylene 414.83
    formic acid 85.08
    diethyl ether 795.09
    m-xylene 487.01
    p-xylene 549.46
    chlorobenzene 486.05
    dimethyl carbonate 247.08
    n-octane 44.41
    formamide 202.48
    cyclopentanone 537.62
    2-pentanone 475.39
    anisole 707.9
    cyclopentyl methyl ether 611.13
    gamma-butyrolactone 496.32
    1-methoxy-2-propanol 529.5
    pyridine 721.12
    3-pentanone 420.75
    furfural 521.87
    n-dodecane 27.95
    diethylene glycol 274.81
    diisopropyl ether 398.43
    tert-amyl alcohol 550.68
    acetylacetone 580.13
    n-hexadecane 32.7
    acetophenone 482.94
    methyl propionate 475.62
    isopentyl acetate 534.68
    trichloroethylene 965.56
    n-nonanol 218.53
    cyclohexanol 326.62
    benzyl alcohol 338.19
    2-ethylhexanol 302.25
    isooctanol 225.17
    dipropyl ether 459.09
    1,2-dichlorobenzene 491.27
    ethyl lactate 174.14
    propylene carbonate 403.7
    n-methylformamide 240.97
    2-pentanol 345.57
    n-pentane 150.28
    1-propoxy-2-propanol 508.92
    1-methoxy-2-propyl acetate 687.02
    2-(2-methoxypropoxy) propanol 525.98
    mesitylene 374.23
    ε-caprolactone 542.73
    p-cymene 252.23
    epichlorohydrin 643.6
    1,1,1-trichloroethane 812.51
    2-aminoethanol 142.79
    morpholine-4-carbaldehyde 729.96
    sulfolane 452.01
    2,2,4-trimethylpentane 111.65
    2-methyltetrahydrofuran 876.47
    n-hexyl acetate 450.27
    isooctane 102.51
    2-(2-butoxyethoxy)ethanol 597.61
    sec-butyl acetate 401.92
    tert-butyl acetate 719.11
    decalin 154.53
    glycerin 125.4
    diglyme 1070.76
    acrylic acid 176.31
    isopropyl myristate 231.05
    n-butyric acid 380.96
    acetyl acetate 517.48
    di(2-ethylhexyl) phthalate 203.13
    ethyl propionate 411.54
    nitromethane 418.04
    1,2-diethoxyethane 698.13
    benzonitrile 369.36
    trioctyl phosphate 129.02
    1-bromopropane 425.86
    gamma-valerolactone 764.22
    n-decanol 163.24
    triethyl phosphate 245.0
    4-methyl-2-pentanol 284.22
    propionitrile 347.79
    vinylene carbonate 380.66
    1,1,2-trichlorotrifluoroethane 473.61
    DMS 396.96
    cumene 308.42
    2-octanol 166.99
    2-hexanone 371.7
    octyl acetate 255.68
    limonene 308.02
    1,2-dimethoxyethane 800.26
    ethyl orthosilicate 264.42
    tributyl phosphate 155.49
    diacetone alcohol 534.27
    N,N-dimethylaniline 533.92
    acrylonitrile 349.36
    aniline 492.65
    1,3-propanediol 232.23
    bromobenzene 561.04
    dibromomethane 597.83
    1,1,2,2-tetrachloroethane 908.84
    2-methyl-cyclohexyl acetate 403.24
    tetrabutyl urea 181.34
    diisobutyl methanol 228.38
    2-phenylethanol 408.85
    styrene 459.99
    dioctyl adipate 301.33
    dimethyl sulfate 300.19
    ethyl butyrate 447.99
    methyl lactate 219.6
    butyl lactate 238.16
    diethyl carbonate 344.18
    propanediol butyl ether 311.01
    triethyl orthoformate 394.04
    p-tert-butyltoluene 281.02
    methyl 4-tert-butylbenzoate 498.93
    morpholine 1091.37
    tert-butylamine 511.56
    n-dodecanol 121.09
    dimethoxymethane 556.07
    ethylene carbonate 327.96
    cyrene 305.49
    2-ethoxyethyl acetate 478.53
    2-ethylhexyl acetate 444.39
    1,2,4-trichlorobenzene 545.01
    4-methylpyridine 764.65
    dibutyl ether 323.03
    2,6-dimethyl-4-heptanol 228.38
    DEF 509.59
    dimethyl isosorbide 763.23
    tetrachloroethylene 581.55
    eugenol 385.52
    triacetin 470.22
    span 80 399.36
    1,4-butanediol 83.26
    1,1-dichloroethane 654.98
    2-methyl-1-pentanol 289.69
    methyl formate 152.68
    2-methyl-1-butanol 334.6
    n-decane 53.91
    butyronitrile 380.07
    3,7-dimethyl-1-octanol 284.61
    1-chlorooctane 177.98
    1-chlorotetradecane 75.82
    n-nonane 51.38
    undecane 36.72
    tert-butylcyclohexane 159.6
    cyclooctane 116.63
    cyclopentanol 251.13
    tetrahydropyran 954.21
    tert-amyl methyl ether 678.56
    2,5,8-trioxanonane 761.84
    1-hexene 334.31
    2-isopropoxyethanol 332.5
    2,2,2-trifluoroethanol 124.06
    methyl butyrate 433.55

    Scent© AI

1 4

IFRA standard 51

Recommendation
Restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 0.031 % Category 7A
Rinse-off products applied to the hair with some hand contact
 0.63 %
Category 2
Products applied to the axillae
 0.057 % Category 7B
Leave-on products applied to the hair with some hand contact
 0.63 %
Category 3
Products applied to the face/body using fingertips
 0.25 % 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
 1.7 %
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
 1.7 %
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)
 4 %
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
 0.031 % Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction