Tetrahydrolinalool

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  • Identifiers

    CAS number
    78-69-3

    Molecular formula
    C10H22O

    SMILES
    CCC(C)(CCCC(C)C)O

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Floral 86.56%
    Sweet 72.55%
    Citrus 60.3%
    Fresh 59.97%
    Woody 59.8%
    Rose 58.72%
    Lily 50.14%
    Lemon 44.37%
    Fruity 40.74%
    Herbal 35.32%

    Scent© AI

  • Properties

    XLogP3-AA
    3.3

    Molecular weight
    158.28 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    197°C

    Flash point est.
    77.89 ˚C

    Solubility expt.

    • soluble in alcohol, most fixed oils; insoluble in water
    • 1 ml in 2 ml 70% alcohol (in ethanol)

  • Synonyms

    • 3,7-Dimethyloctan-3-ol
    • TETRAHYDROLINALOOL
    • 78-69-3
    • 3,7-Dimethyl-3-octanol
    • 3-Octanol, 3,7-dimethyl-
    • 2,6-Dimethyl-6-octanol
    • Linalool tetrahydride
    • 3,7-Dimethyloctanol-3
    • TETRAHYDRO LINALOOL
    • FEMA No. 3060
    • EINECS 201-133-9
    • EINECS 260-912-1
    • UNII-UM4XS5M134
    • NSC 128151
    • (1)-3,7-Dimethyloctan-3-ol
    • CHEBI:84242
    • AI3-24903
    • NSC-128151
    • UM4XS5M134
    • TETRAHYDROLINALOOL [FCC]
    • DTXSID7029110
    • DLHQZZUEERVIGQ-UHFFFAOYSA-
    • FEMA 3060
    • TETRAHYDROLINALOOL [FHFI]
    • EC 201-133-9
    • DTXCID409110
    • CAS-78-69-3
    • 57706-88-4
    • MFCD00004482
    • NSC128151
    • 2,6Dimethyl6octanol
    • 3,7Dimethyloctan3ol
    • 3,7Dimethyloctanol3
    • 3-Octanol,7-dimethyl-
    • 3Octanol, 3,7dimethyl
    • (1)3,7Dimethyloctan3ol
    • SCHEMBL21627
    • CHEMBL3183871
    • 3,7-Dimethyl-3-octanol, 98%
    • Tetrahydrolinalool, >=97%, FCC
    • .+/-.-3,7-Dimethyl-3-octanol
    • AAA07869
    • BCP08646
    • Tox21_202390
    • Tox21_303468
    • AKOS015841872
    • CS-W016195
    • NCGC00249219-01
    • NCGC00257472-01
    • NCGC00259939-01
    • DS-16458
    • 3,7-Dimethyl-3-octanol, analytical standard
    • 3-Octanol, 3,7-dimethyl-, (.+/-.)-
    • NS00003469
    • T0991
    • D78122
    • EN300-179834
    • Q27157612

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4730.83
    methanol 3460.94
    isopropanol 4438.66
    water 1.45
    ethyl acetate 2470.47
    n-propanol 3645.43
    acetone 2173.65
    n-butanol 4335.66
    acetonitrile 1522.23
    DMF 1275.41
    toluene 860.38
    isobutanol 2787.51
    1,4-dioxane 4408.88
    methyl acetate 1531.58
    THF 6267.65
    2-butanone 1957.29
    n-pentanol 2773.3
    sec-butanol 3488.26
    n-hexane 2263.52
    ethylene glycol 303.07
    NMP 1028.92
    cyclohexane 2054.42
    DMSO 1156.42
    n-butyl acetate 3448.81
    n-octanol 1927.21
    chloroform 3373.9
    n-propyl acetate 1593.65
    acetic acid 1427.28
    dichloromethane 2147.84
    cyclohexanone 2661.97
    propylene glycol 785.87
    isopropyl acetate 1885.76
    DMAc 968.92
    2-ethoxyethanol 1926.18
    isopentanol 3723.83
    n-heptane 2276.0
    ethyl formate 1116.41
    1,2-dichloroethane 1383.86
    n-hexanol 5331.69
    2-methoxyethanol 2960.0
    isobutyl acetate 1129.68
    tetrachloromethane 859.08
    n-pentyl acetate 1511.66
    transcutol 4908.44
    n-heptanol 2085.66
    ethylbenzene 570.37
    MIBK 1492.67
    2-propoxyethanol 3935.8
    tert-butanol 5631.85
    MTBE 4728.75
    2-butoxyethanol 2009.86
    propionic acid 1294.42
    o-xylene 525.58
    formic acid 312.21
    diethyl ether 4184.72
    m-xylene 615.41
    p-xylene 786.02
    chlorobenzene 844.95
    dimethyl carbonate 233.57
    n-octane 541.13
    formamide 352.08
    cyclopentanone 2051.18
    2-pentanone 2155.85
    anisole 888.68
    cyclopentyl methyl ether 2756.83
    gamma-butyrolactone 1796.84
    1-methoxy-2-propanol 2530.44
    pyridine 1819.73
    3-pentanone 1183.24
    furfural 1232.31
    n-dodecane 295.84
    diethylene glycol 1473.07
    diisopropyl ether 1630.24
    tert-amyl alcohol 3971.88
    acetylacetone 1257.28
    n-hexadecane 324.15
    acetophenone 585.56
    methyl propionate 1083.86
    isopentyl acetate 2944.18
    trichloroethylene 1826.41
    n-nonanol 1611.51
    cyclohexanol 3121.9
    benzyl alcohol 681.98
    2-ethylhexanol 3366.38
    isooctanol 1591.76
    dipropyl ether 3842.79
    1,2-dichlorobenzene 633.19
    ethyl lactate 511.23
    propylene carbonate 1162.98
    n-methylformamide 724.55
    2-pentanol 3018.47
    n-pentane 1582.76
    1-propoxy-2-propanol 3440.67
    1-methoxy-2-propyl acetate 1950.48
    2-(2-methoxypropoxy) propanol 1258.85
    mesitylene 476.0
    ε-caprolactone 2262.58
    p-cymene 616.87
    epichlorohydrin 2187.21
    1,1,1-trichloroethane 1753.28
    2-aminoethanol 1039.69
    morpholine-4-carbaldehyde 1781.92
    sulfolane 1310.49
    2,2,4-trimethylpentane 565.53
    2-methyltetrahydrofuran 4928.1
    n-hexyl acetate 2214.03
    isooctane 558.79
    2-(2-butoxyethoxy)ethanol 2086.65
    sec-butyl acetate 1250.77
    tert-butyl acetate 1920.15
    decalin 629.45
    glycerin 719.41
    diglyme 3073.21
    acrylic acid 629.91
    isopropyl myristate 818.38
    n-butyric acid 3009.14
    acetyl acetate 919.64
    di(2-ethylhexyl) phthalate 538.98
    ethyl propionate 1186.55
    nitromethane 1127.25
    1,2-diethoxyethane 2760.69
    benzonitrile 964.86
    trioctyl phosphate 514.91
    1-bromopropane 2063.99
    gamma-valerolactone 2712.47
    n-decanol 1111.15
    triethyl phosphate 556.07
    4-methyl-2-pentanol 1823.56
    propionitrile 1828.59
    vinylene carbonate 833.56
    1,1,2-trichlorotrifluoroethane 1237.43
    DMS 615.65
    cumene 447.03
    2-octanol 1388.47
    2-hexanone 1865.33
    octyl acetate 965.54
    limonene 1291.5
    1,2-dimethoxyethane 3387.19
    ethyl orthosilicate 687.69
    tributyl phosphate 616.22
    diacetone alcohol 1660.82
    N,N-dimethylaniline 600.27
    acrylonitrile 1114.03
    aniline 1126.41
    1,3-propanediol 1928.47
    bromobenzene 838.66
    dibromomethane 2004.48
    1,1,2,2-tetrachloroethane 1852.08
    2-methyl-cyclohexyl acetate 1326.27
    tetrabutyl urea 676.4
    diisobutyl methanol 1463.75
    2-phenylethanol 1180.94
    styrene 648.18
    dioctyl adipate 869.81
    dimethyl sulfate 249.21
    ethyl butyrate 2027.5
    methyl lactate 471.96
    butyl lactate 976.16
    diethyl carbonate 964.41
    propanediol butyl ether 1573.21
    triethyl orthoformate 1533.23
    p-tert-butyltoluene 667.91
    methyl 4-tert-butylbenzoate 747.44
    morpholine 5439.14
    tert-butylamine 4659.34
    n-dodecanol 815.68
    dimethoxymethane 1303.21
    ethylene carbonate 963.11
    cyrene 660.26
    2-ethoxyethyl acetate 1294.33
    2-ethylhexyl acetate 2280.73
    1,2,4-trichlorobenzene 672.72
    4-methylpyridine 1913.44
    dibutyl ether 2718.14
    2,6-dimethyl-4-heptanol 1463.75
    DEF 1594.82
    dimethyl isosorbide 1508.78
    tetrachloroethylene 1250.64
    eugenol 653.42
    triacetin 998.8
    span 80 1495.92
    1,4-butanediol 632.53
    1,1-dichloroethane 2008.54
    2-methyl-1-pentanol 2266.65
    methyl formate 429.1
    2-methyl-1-butanol 2877.79
    n-decane 595.09
    butyronitrile 2911.02
    3,7-dimethyl-1-octanol 1778.53
    1-chlorooctane 1181.97
    1-chlorotetradecane 427.22
    n-nonane 663.17
    undecane 395.19
    tert-butylcyclohexane 685.02
    cyclooctane 683.57
    cyclopentanol 2405.8
    tetrahydropyran 6133.78
    tert-amyl methyl ether 2690.45
    2,5,8-trioxanonane 1729.12
    1-hexene 3427.01
    2-isopropoxyethanol 1589.51
    2,2,2-trifluoroethanol 255.87
    methyl butyrate 1586.58

    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