3-(4-Methoxyphenyl)propan-1-ol

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  • Identifiers

    CAS number
    5406-18-8

    Molecular formula
    C10H14O2

    SMILES
    COC1=CC=C(C=C1)CCCO

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Floral 82.81%
    Sweet 66.96%
    Balsamic 54.02%
    Rose 53.31%
    Spicy 45.73%
    Anisic 42.21%
    Fruity 39.28%
    Vanilla 36.3%
    Aromatic 35.98%
    Hyacinth 35.85%

    Scent© AI

  • Properties

    XLogP3-AA
    2.1

    pKa est.
    8.14 (weak base)

    Molecular weight
    166.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    289°C

    Flash point est.
    125.89 ˚C

  • Synonyms

    • 3-(4-Methoxyphenyl)propan-1-ol
    • 5406-18-8
    • 3-(4-Methoxyphenyl)-1-propanol
    • 4-Methoxybenzenepropanol
    • Benzenepropanol, 4-methoxy-
    • 3-(4-methoxyphenyl)propanol
    • 3-(p-Methoxyphenyl)-1-propanol
    • AI3-05562
    • 3-p-Methoxyphenylpropanol
    • EINECS 226-463-0
    • MFCD00002952
    • S9PVU97PBV
    • 1-(4-Methoxyphenyl)-3-propanol
    • DTXSID20202382
    • NSC 5311
    • NSC-5311
    • 1-Propanol, 3-(p-methoxyphenyl)-
    • 3- pound 4-methoxyphenyl)propan-1-ol
    • NSC5311
    • UNII-S9PVU97PBV
    • SCHEMBL79113
    • 3-(4'-methoxyphenyl)-propanol
    • 4-METHOXY-BENZENEPROPANOL
    • DTXCID20124873
    • CHEBI:168467
    • 1-Propanol, 3-(4-methoxyphenyl)
    • 3-(P-METHOXYPHENYL)PROPANOL
    • AKOS005217794
    • AB00287
    • AC-8529
    • CS-W010807
    • 3-(4-Methoxyphenyl)-1-propanol, 99%
    • AS-19079
    • SY101959
    • DB-013360
    • NS00022337
    • F52593
    • EN300-1866578
    • 226-463-0

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2671.78
    methanol 2891.72
    isopropanol 1345.52
    water 3.41
    ethyl acetate 1989.41
    n-propanol 1586.8
    acetone 1111.31
    n-butanol 1126.23
    acetonitrile 1413.22
    DMF 838.98
    toluene 187.04
    isobutanol 758.88
    1,4-dioxane 2861.92
    methyl acetate 1297.81
    THF 1345.81
    2-butanone 709.71
    n-pentanol 581.83
    sec-butanol 689.97
    n-hexane 7.41
    ethylene glycol 955.19
    NMP 248.63
    cyclohexane 28.6
    DMSO 2039.39
    n-butyl acetate 417.93
    n-octanol 94.5
    chloroform 1237.07
    n-propyl acetate 451.25
    acetic acid 1731.26
    dichloromethane 1549.58
    cyclohexanone 644.71
    propylene glycol 1065.94
    isopropyl acetate 478.93
    DMAc 510.2
    2-ethoxyethanol 1459.64
    isopentanol 601.73
    n-heptane 15.38
    ethyl formate 837.05
    1,2-dichloroethane 1055.83
    n-hexanol 424.73
    2-methoxyethanol 2858.03
    isobutyl acetate 209.48
    tetrachloromethane 129.94
    n-pentyl acetate 127.67
    transcutol 2108.89
    n-heptanol 108.43
    ethylbenzene 61.36
    MIBK 242.2
    2-propoxyethanol 874.34
    tert-butanol 1440.3
    MTBE 610.44
    2-butoxyethanol 290.32
    propionic acid 1006.93
    o-xylene 97.48
    formic acid 863.38
    diethyl ether 866.86
    m-xylene 114.44
    p-xylene 70.07
    chlorobenzene 251.92
    dimethyl carbonate 273.1
    n-octane 6.28
    formamide 1382.95
    cyclopentanone 603.86
    2-pentanone 585.48
    anisole 263.41
    cyclopentyl methyl ether 454.16
    gamma-butyrolactone 936.5
    1-methoxy-2-propanol 1340.23
    pyridine 833.18
    3-pentanone 341.51
    furfural 759.15
    n-dodecane 6.89
    diethylene glycol 1007.57
    diisopropyl ether 114.65
    tert-amyl alcohol 619.64
    acetylacetone 648.15
    n-hexadecane 7.67
    acetophenone 183.69
    methyl propionate 840.13
    isopentyl acetate 286.09
    trichloroethylene 1653.72
    n-nonanol 82.58
    cyclohexanol 471.12
    benzyl alcohol 282.21
    2-ethylhexanol 160.27
    isooctanol 80.86
    dipropyl ether 230.39
    1,2-dichlorobenzene 190.3
    ethyl lactate 188.06
    propylene carbonate 465.29
    n-methylformamide 1027.6
    2-pentanol 460.96
    n-pentane 11.73
    1-propoxy-2-propanol 438.54
    1-methoxy-2-propyl acetate 430.53
    2-(2-methoxypropoxy) propanol 244.11
    mesitylene 61.37
    ε-caprolactone 594.17
    p-cymene 46.46
    epichlorohydrin 1464.87
    1,1,1-trichloroethane 635.51
    2-aminoethanol 1458.04
    morpholine-4-carbaldehyde 843.08
    sulfolane 693.41
    2,2,4-trimethylpentane 12.27
    2-methyltetrahydrofuran 867.63
    n-hexyl acetate 163.66
    isooctane 10.61
    2-(2-butoxyethoxy)ethanol 389.26
    sec-butyl acetate 215.25
    tert-butyl acetate 376.72
    decalin 14.44
    glycerin 1066.32
    diglyme 836.95
    acrylic acid 686.16
    isopropyl myristate 64.07
    n-butyric acid 1266.06
    acetyl acetate 645.34
    di(2-ethylhexyl) phthalate 73.06
    ethyl propionate 333.5
    nitromethane 2381.27
    1,2-diethoxyethane 569.2
    benzonitrile 257.57
    trioctyl phosphate 52.68
    1-bromopropane 385.11
    gamma-valerolactone 1030.56
    n-decanol 63.21
    triethyl phosphate 104.65
    4-methyl-2-pentanol 159.56
    propionitrile 752.72
    vinylene carbonate 464.07
    1,1,2-trichlorotrifluoroethane 887.69
    DMS 198.46
    cumene 43.72
    2-octanol 57.06
    2-hexanone 262.57
    octyl acetate 81.42
    limonene 77.5
    1,2-dimethoxyethane 1347.42
    ethyl orthosilicate 109.17
    tributyl phosphate 71.33
    diacetone alcohol 450.22
    N,N-dimethylaniline 121.69
    acrylonitrile 858.64
    aniline 411.76
    1,3-propanediol 1793.55
    bromobenzene 237.28
    dibromomethane 748.97
    1,1,2,2-tetrachloroethane 1046.22
    2-methyl-cyclohexyl acetate 140.48
    tetrabutyl urea 85.54
    diisobutyl methanol 90.39
    2-phenylethanol 225.28
    styrene 93.02
    dioctyl adipate 109.21
    dimethyl sulfate 302.68
    ethyl butyrate 282.65
    methyl lactate 332.46
    butyl lactate 123.04
    diethyl carbonate 193.96
    propanediol butyl ether 252.05
    triethyl orthoformate 173.96
    p-tert-butyltoluene 47.72
    methyl 4-tert-butylbenzoate 142.51
    morpholine 2910.46
    tert-butylamine 589.73
    n-dodecanol 50.74
    dimethoxymethane 1114.28
    ethylene carbonate 460.65
    cyrene 198.11
    2-ethoxyethyl acetate 294.99
    2-ethylhexyl acetate 187.94
    1,2,4-trichlorobenzene 231.7
    4-methylpyridine 551.49
    dibutyl ether 132.34
    2,6-dimethyl-4-heptanol 90.39
    DEF 618.78
    dimethyl isosorbide 335.25
    tetrachloroethylene 670.52
    eugenol 161.78
    triacetin 210.12
    span 80 189.28
    1,4-butanediol 549.26
    1,1-dichloroethane 866.66
    2-methyl-1-pentanol 306.65
    methyl formate 763.48
    2-methyl-1-butanol 488.42
    n-decane 10.44
    butyronitrile 713.77
    3,7-dimethyl-1-octanol 94.42
    1-chlorooctane 51.96
    1-chlorotetradecane 22.59
    n-nonane 9.4
    undecane 8.02
    tert-butylcyclohexane 15.01
    cyclooctane 10.21
    cyclopentanol 466.88
    tetrahydropyran 1359.12
    tert-amyl methyl ether 285.69
    2,5,8-trioxanonane 516.64
    1-hexene 62.46
    2-isopropoxyethanol 628.99
    2,2,2-trifluoroethanol 383.3
    methyl butyrate 462.74

    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