Cedrenyl acetate

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  • Identifiers

    CAS number
    1405-92-1

    Molecular formula
    C17H26O2

    SMILES
    C[C@@H]1CC[C@@H]2[C@]13CC=C([C@H](C3)C2(C)C)COC(=O)C

  • Odor profile

    Fragrance
    Woody 91.75%
    Cedar 56.36%
    Amber 54.05%
    Dry 50.04%
    Sandalwood 45.23%
    Vetiver 44.3%
    Balsamic 43.17%
    Sweet 41.78%
    Powdery 39.78%
    Pine 38.49%

     

    Flavor
    Sweet 60.12%
    Woody 54.94%
    Pine 45.59%
    Herbal 44.22%
    Balsam 44.1%
    Camphor 37.45%
    Fresh 30.84%
    Wood 30.56%
    Citrus 30.26%
    Dry 30.17%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.9

    pKa est.
    7.96 (neutral)

    Molecular weight
    262.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    338°C

    Flash point

    • 149.13 ˚C est.

  • Synonyms

    • Cedrenyl acetate
    • Cedrenol, acetate
    • 1405-92-1
    • EINECS 215-789-9
    • [(1S,2R,5S,7R)-2,6,6-trimethyl-8-tricyclo[5.3.1.01,5]undec-8-enyl]methyl acetate
    • cedr-8-en-15-yl acetate
    • 1H-3a,7-Methanoazulene-6-methanol, 2,3,4,7,8,8a-hexahydro-3,8,8-trimethyl-, 6-acetate, (3R,3aS,7R,8aS)-
    • Cedrenol, acetate (8CI)
    • SCHEMBL2574341
    • DTXSID3051709
    • AICQDCHSUWFHCC-ZUFFMMDNSA-N
    • (3R-(3alpha,3Abeta,7beta,8aalpha))-2,3,4,7,8,8a-hexahydro-3,8,8-trimethyl-1H-3a,7-methanoazulene-6-methyl acetate
    • NS00012086

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 274.88
    methanol 248.9
    isopropanol 285.93
    water 1.65
    ethyl acetate 783.32
    n-propanol 340.27
    acetone 791.91
    n-butanol 311.43
    acetonitrile 469.98
    DMF 1005.66
    toluene 1059.53
    isobutanol 246.29
    1,4-dioxane 1235.71
    methyl acetate 523.38
    THF 1999.82
    2-butanone 619.47
    n-pentanol 104.58
    sec-butanol 186.84
    n-hexane 14.2
    ethylene glycol 65.82
    NMP 586.29
    cyclohexane 81.86
    DMSO 436.11
    n-butyl acetate 301.33
    n-octanol 54.19
    chloroform 2315.71
    n-propyl acetate 243.21
    acetic acid 254.68
    dichloromethane 1549.36
    cyclohexanone 849.2
    propylene glycol 87.91
    isopropyl acetate 578.06
    DMAc 643.22
    2-ethoxyethanol 231.84
    isopentanol 279.21
    n-heptane 9.18
    ethyl formate 271.55
    1,2-dichloroethane 968.73
    n-hexanol 169.66
    2-methoxyethanol 590.06
    isobutyl acetate 190.89
    tetrachloromethane 266.1
    n-pentyl acetate 178.1
    transcutol 1056.99
    n-heptanol 77.04
    ethylbenzene 227.93
    MIBK 379.32
    2-propoxyethanol 435.35
    tert-butanol 326.53
    MTBE 456.51
    2-butoxyethanol 218.92
    propionic acid 239.15
    o-xylene 379.47
    formic acid 117.84
    diethyl ether 595.84
    m-xylene 545.25
    p-xylene 272.13
    chlorobenzene 760.52
    dimethyl carbonate 416.91
    n-octane 3.42
    formamide 256.16
    cyclopentanone 1074.12
    2-pentanone 617.74
    anisole 482.13
    cyclopentyl methyl ether 772.36
    gamma-butyrolactone 1011.97
    1-methoxy-2-propanol 573.23
    pyridine 1090.29
    3-pentanone 493.9
    furfural 812.63
    n-dodecane 2.92
    diethylene glycol 323.86
    diisopropyl ether 176.94
    tert-amyl alcohol 195.86
    acetylacetone 800.82
    n-hexadecane 3.72
    acetophenone 355.53
    methyl propionate 610.45
    isopentyl acetate 309.78
    trichloroethylene 1912.64
    n-nonanol 55.39
    cyclohexanol 339.89
    benzyl alcohol 277.74
    2-ethylhexanol 91.56
    isooctanol 67.34
    dipropyl ether 139.95
    1,2-dichlorobenzene 595.83
    ethyl lactate 130.48
    propylene carbonate 537.88
    n-methylformamide 479.24
    2-pentanol 194.33
    n-pentane 26.8
    1-propoxy-2-propanol 272.07
    1-methoxy-2-propyl acetate 516.23
    2-(2-methoxypropoxy) propanol 215.12
    mesitylene 259.55
    ε-caprolactone 696.41
    p-cymene 95.75
    epichlorohydrin 1403.36
    1,1,1-trichloroethane 950.15
    2-aminoethanol 150.33
    morpholine-4-carbaldehyde 804.45
    sulfolane 755.21
    2,2,4-trimethylpentane 15.34
    2-methyltetrahydrofuran 959.61
    n-hexyl acetate 218.5
    isooctane 14.65
    2-(2-butoxyethoxy)ethanol 292.22
    sec-butyl acetate 232.28
    tert-butyl acetate 503.26
    decalin 28.16
    glycerin 165.38
    diglyme 650.1
    acrylic acid 227.1
    isopropyl myristate 78.72
    n-butyric acid 411.79
    acetyl acetate 547.14
    di(2-ethylhexyl) phthalate 94.95
    ethyl propionate 284.67
    nitromethane 671.3
    1,2-diethoxyethane 331.07
    benzonitrile 426.56
    trioctyl phosphate 61.13
    1-bromopropane 520.91
    gamma-valerolactone 1284.6
    n-decanol 38.89
    triethyl phosphate 109.81
    4-methyl-2-pentanol 140.69
    propionitrile 450.93
    vinylene carbonate 563.53
    1,1,2-trichlorotrifluoroethane 626.77
    DMS 352.5
    cumene 126.02
    2-octanol 42.71
    2-hexanone 201.39
    octyl acetate 96.46
    limonene 109.32
    1,2-dimethoxyethane 508.47
    ethyl orthosilicate 105.73
    tributyl phosphate 77.4
    diacetone alcohol 380.07
    N,N-dimethylaniline 246.84
    acrylonitrile 533.43
    aniline 809.84
    1,3-propanediol 270.08
    bromobenzene 851.1
    dibromomethane 967.16
    1,1,2,2-tetrachloroethane 1450.01
    2-methyl-cyclohexyl acetate 172.87
    tetrabutyl urea 91.16
    diisobutyl methanol 67.18
    2-phenylethanol 283.79
    styrene 304.48
    dioctyl adipate 116.5
    dimethyl sulfate 485.25
    ethyl butyrate 202.04
    methyl lactate 267.36
    butyl lactate 148.55
    diethyl carbonate 159.26
    propanediol butyl ether 170.42
    triethyl orthoformate 156.73
    p-tert-butyltoluene 98.48
    methyl 4-tert-butylbenzoate 246.03
    morpholine 1287.78
    tert-butylamine 207.75
    n-dodecanol 28.1
    dimethoxymethane 949.62
    ethylene carbonate 504.16
    cyrene 212.51
    2-ethoxyethyl acetate 364.66
    2-ethylhexyl acetate 233.28
    1,2,4-trichlorobenzene 679.8
    4-methylpyridine 1142.8
    dibutyl ether 80.03
    2,6-dimethyl-4-heptanol 67.18
    DEF 487.29
    dimethyl isosorbide 410.55
    tetrachloroethylene 788.95
    eugenol 230.53
    triacetin 264.55
    span 80 162.8
    1,4-butanediol 65.75
    1,1-dichloroethane 1014.5
    2-methyl-1-pentanol 114.13
    methyl formate 347.49
    2-methyl-1-butanol 225.87
    n-decane 5.5
    butyronitrile 391.89
    3,7-dimethyl-1-octanol 75.5
    1-chlorooctane 41.92
    1-chlorotetradecane 15.29
    n-nonane 4.66
    undecane 3.87
    tert-butylcyclohexane 20.69
    cyclooctane 23.68
    cyclopentanol 321.97
    tetrahydropyran 1250.41
    tert-amyl methyl ether 257.93
    2,5,8-trioxanonane 356.42
    1-hexene 66.36
    2-isopropoxyethanol 172.72
    2,2,2-trifluoroethanol 197.42
    methyl butyrate 289.29

    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