Citronelloxyacetaldehyde

  • Identifiers

    CAS number
    7492-67-3

    Molecular formula
    C12H22O2

    SMILES
    CC(CCC=C(C)C)CCOCC=O

  • Odor profile

    Fragrance
    Floral 90.76%
    Sweet 73.61%
    Green 73.38%
    Fresh 71.78%
    Rose 71.66%
    Citrus 67.88%
    Waxy 67.51%
    Aldehydic 62.39%
    Lily 59.29%
    Muguet 55.41%

     

    Flavor
    Floral 67.12%
    Green 65.85%
    Waxy 59.62%
    Rose 55.46%
    Bitter 42.54%
    Fresh 41.15%
    Sweet 40.5%
    Citrus 40.21%
    Herbal 38.15%
    Fruity 37.52%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.3

    pKa est.
    7.93 (neutral)

    Molecular weight
    198.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point

    • 130.00 °C. @ 12.00 mm Hg

    Flash point

    • 104.04 ˚C est.

    Solubility expt.

    • insoluble in water; soluble in alcohol

  • Synonyms

    • Citronellyloxyacetaldehyde
    • 7492-67-3
    • CITRONELLOXYACETALDEHYDE
    • Muget aldehyde
    • 6,10-Dimethyl-3-oxa-9-undecenal
    • 2-(3,7-dimethyloct-6-enoxy)acetaldehyde
    • Muguet aldehyde
    • FEMA No. 2310
    • [(3,7-dimethyl-6-octenyl)oxy]acetaldehyde
    • ((3,7-Dimethyl-6-octenyl)oxy)acetaldehyde
    • citronellyl oxyacetaldehyde
    • EINECS 231-324-2
    • UNII-6PS292RE8D
    • NSC 46126
    • BRN 1767678
    • MUGENAL
    • 6PS292RE8D
    • AI3-36126
    • Acetaldehyde, ((3,7-dimethyl-6-octenyl)oxy)-
    • NSC-46126
    • Acetaldehyde, 2-((3,7-dimethyl-6-octen-1-yl)oxy)-
    • DTXSID7052492
    • Acetaldehyde, [(3,7-dimethyl-6-octenyl)oxy]-
    • 2-[(3,7-dimethyloct-6-en-1-yl)oxy]acetaldehyde
    • 2-01-00-00864 (Beilstein Handbook Reference)
    • (+/-)-CITRONELLOXYACETALDEHYDE
    • CITRONELLYL OXYACETALDEHYDE [FHFI]
    • CITRONELLOXYACETALDEHYDE, (+/-)-
    • ((3,7-dimethyl-6-octenyl)oxy)-Acetaldehyde
    • [(3,7-dimethyl-6-octenyl)oxy]-acetaldehyde
    • 2-((3,7-Dimethyloct-6-en-1-yl)oxy)acetaldehyde
    • Acetaldehyde, 2-[(3,7-dimethyl-6-octen-1-yl)oxy]-
    • Fema 2310
    • NSC46126
    • SCHEMBL130555
    • CHEMBL3729330
    • DTXCID4031065
    • CHEBI:171839
    • 6,10-Dimethyl-3-oxa-9-undecanal
    • AKOS006273758
    • Acetaldehyde,7-dimethyl-6-octenyl)oxy]-
    • NS00012117
    • 2-((3,7-Dimethyl-6-octen-1-yl)oxy)-Acetaldehyde
    • Q27265298
  • Applications

    Citronelloxyacetaldehyde (CAS 7492-67-3) is primarily used as an intermediate in fragrance chemistry, enabling the synthesis of citronellol- and citrus-derived aroma compounds. It can be employed as a fragrance ingredient or odorant in perfumery and in cosmetics/personal care formulations, contributing citrus/green notes. In household products, it may be added as a fragrance component to impart a fresh citrus scent. As a reactive aldehyde derivative, it is sometimes evaluated for use in the production of related fragrance chemicals and as a building block in coatings/inks with fragrance attributes. It is typically handled as an intermediate and is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1444.42
    methanol 1233.02
    isopropanol 958.12
    water 0.38
    ethyl acetate 797.35
    n-propanol 951.29
    acetone 707.43
    n-butanol 945.18
    acetonitrile 573.49
    DMF 289.54
    toluene 291.29
    isobutanol 565.19
    1,4-dioxane 1344.43
    methyl acetate 506.96
    THF 1372.3
    2-butanone 624.9
    n-pentanol 608.83
    sec-butanol 709.13
    n-hexane 102.28
    ethylene glycol 118.42
    NMP 263.54
    cyclohexane 237.95
    DMSO 676.15
    n-butyl acetate 558.17
    n-octanol 158.38
    chloroform 1621.0
    n-propyl acetate 498.09
    acetic acid 583.54
    dichloromethane 1321.18
    cyclohexanone 788.42
    propylene glycol 300.83
    isopropyl acetate 384.2
    DMAc 300.46
    2-ethoxyethanol 784.49
    isopentanol 630.59
    n-heptane 70.21
    ethyl formate 375.06
    1,2-dichloroethane 796.55
    n-hexanol 621.47
    2-methoxyethanol 1069.65
    isobutyl acetate 279.9
    tetrachloromethane 242.15
    n-pentyl acetate 237.56
    transcutol 2128.08
    n-heptanol 175.39
    ethylbenzene 157.77
    MIBK 295.79
    2-propoxyethanol 783.9
    tert-butanol 930.54
    MTBE 634.63
    2-butoxyethanol 332.35
    propionic acid 410.02
    o-xylene 171.01
    formic acid 149.93
    diethyl ether 896.61
    m-xylene 198.26
    p-xylene 184.32
    chlorobenzene 322.63
    dimethyl carbonate 74.99
    n-octane 20.09
    formamide 177.54
    cyclopentanone 573.42
    2-pentanone 535.96
    anisole 296.74
    cyclopentyl methyl ether 601.51
    gamma-butyrolactone 561.43
    1-methoxy-2-propanol 733.71
    pyridine 757.76
    3-pentanone 327.21
    furfural 562.28
    n-dodecane 13.17
    diethylene glycol 454.63
    diisopropyl ether 174.52
    tert-amyl alcohol 608.07
    acetylacetone 427.95
    n-hexadecane 15.39
    acetophenone 262.3
    methyl propionate 355.9
    isopentyl acetate 459.55
    trichloroethylene 1260.15
    n-nonanol 140.37
    cyclohexanol 703.96
    benzyl alcohol 297.55
    2-ethylhexanol 327.23
    isooctanol 144.65
    dipropyl ether 420.18
    1,2-dichlorobenzene 286.24
    ethyl lactate 188.03
    propylene carbonate 365.49
    n-methylformamide 225.26
    2-pentanol 572.46
    n-pentane 96.0
    1-propoxy-2-propanol 611.37
    1-methoxy-2-propyl acetate 459.47
    2-(2-methoxypropoxy) propanol 342.73
    mesitylene 123.7
    ε-caprolactone 672.25
    p-cymene 112.34
    epichlorohydrin 955.21
    1,1,1-trichloroethane 736.66
    2-aminoethanol 357.11
    morpholine-4-carbaldehyde 510.21
    sulfolane 495.96
    2,2,4-trimethylpentane 41.13
    2-methyltetrahydrofuran 1088.75
    n-hexyl acetate 318.71
    isooctane 33.52
    2-(2-butoxyethoxy)ethanol 486.53
    sec-butyl acetate 315.91
    tert-butyl acetate 374.64
    decalin 64.09
    glycerin 267.95
    diglyme 925.3
    acrylic acid 250.51
    isopropyl myristate 115.73
    n-butyric acid 763.62
    acetyl acetate 332.54
    di(2-ethylhexyl) phthalate 116.5
    ethyl propionate 339.03
    nitromethane 633.94
    1,2-diethoxyethane 665.29
    benzonitrile 347.94
    trioctyl phosphate 77.05
    1-bromopropane 620.59
    gamma-valerolactone 821.59
    n-decanol 98.86
    triethyl phosphate 148.31
    4-methyl-2-pentanol 252.82
    propionitrile 477.42
    vinylene carbonate 318.88
    1,1,2-trichlorotrifluoroethane 583.76
    DMS 205.97
    cumene 105.86
    2-octanol 107.31
    2-hexanone 461.55
    octyl acetate 135.39
    limonene 193.21
    1,2-dimethoxyethane 955.23
    ethyl orthosilicate 163.79
    tributyl phosphate 109.62
    diacetone alcohol 393.95
    N,N-dimethylaniline 169.63
    acrylonitrile 412.33
    aniline 390.37
    1,3-propanediol 571.67
    bromobenzene 334.72
    dibromomethane 966.31
    1,1,2,2-tetrachloroethane 1050.56
    2-methyl-cyclohexyl acetate 276.71
    tetrabutyl urea 124.36
    diisobutyl methanol 176.53
    2-phenylethanol 295.8
    styrene 194.0
    dioctyl adipate 191.53
    dimethyl sulfate 99.15
    ethyl butyrate 402.07
    methyl lactate 151.67
    butyl lactate 197.54
    diethyl carbonate 237.27
    propanediol butyl ether 300.89
    triethyl orthoformate 278.96
    p-tert-butyltoluene 112.34
    methyl 4-tert-butylbenzoate 206.68
    morpholine 1713.35
    tert-butylamine 580.94
    n-dodecanol 75.99
    dimethoxymethane 343.79
    ethylene carbonate 307.73
    cyrene 236.97
    2-ethoxyethyl acetate 351.43
    2-ethylhexyl acetate 354.42
    1,2,4-trichlorobenzene 333.88
    4-methylpyridine 623.5
    dibutyl ether 276.41
    2,6-dimethyl-4-heptanol 176.53
    DEF 410.87
    dimethyl isosorbide 451.86
    tetrachloroethylene 676.25
    eugenol 203.96
    triacetin 304.07
    span 80 292.16
    1,4-butanediol 229.23
    1,1-dichloroethane 842.44
    2-methyl-1-pentanol 410.06
    methyl formate 148.57
    2-methyl-1-butanol 534.72
    n-decane 26.11
    butyronitrile 629.37
    3,7-dimethyl-1-octanol 189.75
    1-chlorooctane 111.32
    1-chlorotetradecane 41.04
    n-nonane 26.57
    undecane 17.52
    tert-butylcyclohexane 55.48
    cyclooctane 56.98
    cyclopentanol 500.95
    tetrahydropyran 1648.57
    tert-amyl methyl ether 390.02
    2,5,8-trioxanonane 550.12
    1-hexene 360.84
    2-isopropoxyethanol 476.25
    2,2,2-trifluoroethanol 117.57
    methyl butyrate 473.76

    Scent© AI

1 of 4
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