3-Methyl-3,4-divinylcyclohexene

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C11H16

    SMILES
    CC1(C=CCCC1C=C)C=C

  • Odor profile

    Green 66.12%
    Herbal 60.09%
    Woody 54.88%
    Citrus 53.4%
    Spicy 47.83%
    Fresh 43.77%
    Sweet 41.25%
    Terpenic 40.56%
    Fruity 39.94%
    Oily 35.87%

    Scent© AI

  • Properties

    XLogP3-AA
    4.0

    Molecular weight
    148.24 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very fast

    Boiling point est.
    162°C

    Flash point est.
    62.57 ˚C

  • Synonyms

    • 3-Methyl-3,4-divinylcyclohexene
    • 61141-77-3
    • Cyclohexene, 3,4-diethenyl-3-methyl-
    • WRNRNPOLSGTBHQ-UHFFFAOYSA-N
    • 3,4-di(ethenyl)-3-methyl-cyclohexene
    • 3-Methyl-3,4-divinyl-1-cyclohexene #
    • DB-304735

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 703.75
    methanol 449.27
    isopropanol 667.94
    water 0.14
    ethyl acetate 1081.22
    n-propanol 699.07
    acetone 909.22
    n-butanol 762.72
    acetonitrile 720.47
    DMF 657.32
    toluene 850.03
    isobutanol 544.68
    1,4-dioxane 1801.81
    methyl acetate 827.82
    THF 2887.11
    2-butanone 989.18
    n-pentanol 461.15
    sec-butanol 592.91
    n-hexane 488.01
    ethylene glycol 37.69
    NMP 637.53
    cyclohexane 626.09
    DMSO 661.4
    n-butyl acetate 1708.57
    n-octanol 372.21
    chloroform 1442.41
    n-propyl acetate 720.51
    acetic acid 210.7
    dichloromethane 1322.27
    cyclohexanone 1282.21
    propylene glycol 79.81
    isopropyl acetate 708.83
    DMAc 436.41
    2-ethoxyethanol 405.28
    isopentanol 662.91
    n-heptane 465.39
    ethyl formate 463.85
    1,2-dichloroethane 1060.49
    n-hexanol 1166.0
    2-methoxyethanol 558.37
    isobutyl acetate 485.0
    tetrachloromethane 494.3
    n-pentyl acetate 530.95
    transcutol 1549.69
    n-heptanol 400.18
    ethylbenzene 344.2
    MIBK 677.6
    2-propoxyethanol 1046.98
    tert-butanol 906.43
    MTBE 1402.79
    2-butoxyethanol 467.09
    propionic acid 310.16
    o-xylene 377.22
    formic acid 37.42
    diethyl ether 1939.21
    m-xylene 563.31
    p-xylene 356.78
    chlorobenzene 678.25
    dimethyl carbonate 219.34
    n-octane 144.5
    formamide 72.29
    cyclopentanone 1340.74
    2-pentanone 969.14
    anisole 555.94
    cyclopentyl methyl ether 1413.06
    gamma-butyrolactone 1128.19
    1-methoxy-2-propanol 601.9
    pyridine 1044.94
    3-pentanone 693.17
    furfural 633.97
    n-dodecane 84.54
    diethylene glycol 333.65
    diisopropyl ether 614.75
    tert-amyl alcohol 656.58
    acetylacetone 699.68
    n-hexadecane 96.58
    acetophenone 354.92
    methyl propionate 649.38
    isopentyl acetate 1176.32
    trichloroethylene 1268.83
    n-nonanol 326.16
    cyclohexanol 664.6
    benzyl alcohol 269.81
    2-ethylhexanol 778.47
    isooctanol 348.72
    dipropyl ether 1338.17
    1,2-dichlorobenzene 498.23
    ethyl lactate 170.47
    propylene carbonate 617.7
    n-methylformamide 285.74
    2-pentanol 617.55
    n-pentane 472.88
    1-propoxy-2-propanol 938.67
    1-methoxy-2-propyl acetate 835.81
    2-(2-methoxypropoxy) propanol 375.85
    mesitylene 382.79
    ε-caprolactone 945.87
    p-cymene 293.29
    epichlorohydrin 1349.27
    1,1,1-trichloroethane 1141.91
    2-aminoethanol 120.63
    morpholine-4-carbaldehyde 702.94
    sulfolane 976.55
    2,2,4-trimethylpentane 173.0
    2-methyltetrahydrofuran 2023.56
    n-hexyl acetate 645.99
    isooctane 203.61
    2-(2-butoxyethoxy)ethanol 563.35
    sec-butyl acetate 465.49
    tert-butyl acetate 816.8
    decalin 222.01
    glycerin 96.78
    diglyme 954.38
    acrylic acid 167.29
    isopropyl myristate 297.44
    n-butyric acid 655.49
    acetyl acetate 432.77
    di(2-ethylhexyl) phthalate 183.97
    ethyl propionate 544.46
    nitromethane 416.94
    1,2-diethoxyethane 1188.97
    benzonitrile 451.29
    trioctyl phosphate 173.52
    1-bromopropane 1306.75
    gamma-valerolactone 1128.83
    n-decanol 258.37
    triethyl phosphate 232.9
    4-methyl-2-pentanol 406.63
    propionitrile 852.29
    vinylene carbonate 486.68
    1,1,2-trichlorotrifluoroethane 384.28
    DMS 357.1
    cumene 227.21
    2-octanol 287.2
    2-hexanone 724.45
    octyl acetate 338.72
    limonene 499.78
    1,2-dimethoxyethane 980.1
    ethyl orthosilicate 262.31
    tributyl phosphate 208.44
    diacetone alcohol 608.46
    N,N-dimethylaniline 313.34
    acrylonitrile 631.1
    aniline 558.46
    1,3-propanediol 268.26
    bromobenzene 833.46
    dibromomethane 1203.52
    1,1,2,2-tetrachloroethane 964.23
    2-methyl-cyclohexyl acetate 474.28
    tetrabutyl urea 235.64
    diisobutyl methanol 419.65
    2-phenylethanol 501.63
    styrene 422.09
    dioctyl adipate 285.89
    dimethyl sulfate 258.09
    ethyl butyrate 874.67
    methyl lactate 181.99
    butyl lactate 265.91
    diethyl carbonate 440.06
    propanediol butyl ether 288.7
    triethyl orthoformate 483.23
    p-tert-butyltoluene 311.48
    methyl 4-tert-butylbenzoate 335.2
    morpholine 1688.18
    tert-butylamine 757.83
    n-dodecanol 208.42
    dimethoxymethane 824.57
    ethylene carbonate 495.77
    cyrene 248.02
    2-ethoxyethyl acetate 541.61
    2-ethylhexyl acetate 968.71
    1,2,4-trichlorobenzene 505.74
    4-methylpyridine 1083.13
    dibutyl ether 757.77
    2,6-dimethyl-4-heptanol 419.65
    DEF 734.81
    dimethyl isosorbide 679.1
    tetrachloroethylene 626.38
    eugenol 289.17
    triacetin 341.97
    span 80 344.06
    1,4-butanediol 90.15
    1,1-dichloroethane 1288.04
    2-methyl-1-pentanol 430.05
    methyl formate 249.25
    2-methyl-1-butanol 609.64
    n-decane 144.16
    butyronitrile 1036.1
    3,7-dimethyl-1-octanol 416.17
    1-chlorooctane 395.51
    1-chlorotetradecane 166.09
    n-nonane 165.53
    undecane 107.28
    tert-butylcyclohexane 222.12
    cyclooctane 277.45
    cyclopentanol 614.45
    tetrahydropyran 2449.95
    tert-amyl methyl ether 801.64
    2,5,8-trioxanonane 579.87
    1-hexene 963.04
    2-isopropoxyethanol 386.26
    2,2,2-trifluoroethanol 66.82
    methyl butyrate 683.43

    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
Clausena dunniana (China) 1 Clausena dunniana Levl., fam. Rutaceae 0.74%
Clausena dunniana (China) 2 Clausena dunniana Levl., fam. Rutaceae 1.57%