Citronellyl anthranilate

  • Identifiers

    CAS number
    68555-57-7

    Molecular formula
    C17H25NO2

    SMILES
    CC(CCC=C(C)C)CCOC(=O)C1=CC=CC=C1N

  • Odor profile

    Fragrance
    Floral 87.3%
    Sweet 67.03%
    Rose 65.49%
    Fruity 63.99%
    Grape 50.74%
    Fresh 48.86%
    Citrus 47.26%
    Neroli 44.65%
    Lily 41.55%
    Orange 38.05%

     

    Flavor
    Floral 48.92%
    Herbal 46.23%
    Woody 41.29%
    Fruity 30.77%
    Bitter 29.64%
    Balsam 26.96%
    Sweet 25.69%
    Warm 24.98%
    Green 24.08%
    Spicy 24.08%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.9

    pKa est.
    6.3 (neutral)

    Molecular weight
    275.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point

    • 365.00 °C. @ 760.00 mm Hg

    Flash point

    • 173.8 ˚C est.

    Solubility expt.

    • Insoluble in water
    • Soluble (in ethanol)

  • Synonyms

    • Citronellyl anthranilate
    • 3,7-Dimethyloct-6-enyl 2-aminobenzoate
    • 68555-57-7
    • 6-Octen-1-ol, 3,7-dimethyl-, 2-aminobenzoate
    • UNII-151MU54E8I
    • 6-Octen-1-ol, 3,7-dimethyl-, 1-(2-aminobenzoate)
    • 151MU54E8I
    • 3,7-dimethyloct-6-en-1-yl 2-aminobenzoate
    • EINECS 271-433-2
    • FEMA NO. 4086
    • DTXSID40867674
    • CITRONELLYL ANTHRANILATE [FHFI]
    • 3,7-Dimethyl-6-octen-1-ol-2-aminobenzoate
    • SCHEMBL2419517
    • DTXCID70815845
    • CHEBI:172321
    • 3,7-Dimethyl-6-octenyl 2-aminobenzoate #
    • NS00062760
    • Q27251666
  • Applications

    Citronellyl anthranilate (CAS 68555-57-7) is primarily used as a fragrance ingredient in perfumery, providing citrus-floral notes and acting as a fixative to extend fragrance longevity in formulations. It is also employed in cosmetics and personal care products to impart a scented profile, and in household products such as air fresheners and cleaners to contribute a fresh fragrance. Additionally, it may be evaluated for flavor/aroma applications in appropriate contexts within aroma chemistry, reflecting its odor-active ester character. Its use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1475.0
    methanol 1321.17
    isopropanol 1025.18
    water 0.18
    ethyl acetate 927.53
    n-propanol 1056.35
    acetone 1424.07
    n-butanol 862.94
    acetonitrile 702.31
    DMF 920.14
    toluene 316.53
    isobutanol 640.95
    1,4-dioxane 1417.14
    methyl acetate 660.41
    THF 1866.61
    2-butanone 973.0
    n-pentanol 495.37
    sec-butanol 712.3
    n-hexane 11.36
    ethylene glycol 54.06
    NMP 618.87
    cyclohexane 41.84
    DMSO 1346.56
    n-butyl acetate 367.84
    n-octanol 102.16
    chloroform 1552.03
    n-propyl acetate 378.95
    acetic acid 680.6
    dichloromethane 1400.94
    cyclohexanone 1003.12
    propylene glycol 235.63
    isopropyl acetate 404.04
    DMAc 746.89
    2-ethoxyethanol 580.72
    isopentanol 581.03
    n-heptane 6.48
    ethyl formate 425.09
    1,2-dichloroethane 1010.55
    n-hexanol 382.0
    2-methoxyethanol 1287.99
    isobutyl acetate 212.82
    tetrachloromethane 107.1
    n-pentyl acetate 193.6
    transcutol 1735.24
    n-heptanol 137.13
    ethylbenzene 95.56
    MIBK 329.2
    2-propoxyethanol 631.43
    tert-butanol 749.58
    MTBE 498.63
    2-butoxyethanol 319.19
    propionic acid 409.13
    o-xylene 126.49
    formic acid 154.27
    diethyl ether 638.83
    m-xylene 159.98
    p-xylene 130.49
    chlorobenzene 401.8
    dimethyl carbonate 167.9
    n-octane 3.39
    formamide 307.53
    cyclopentanone 1171.35
    2-pentanone 764.17
    anisole 257.83
    cyclopentyl methyl ether 562.09
    gamma-butyrolactone 1016.72
    1-methoxy-2-propanol 907.67
    pyridine 889.72
    3-pentanone 435.0
    furfural 657.34
    n-dodecane 3.33
    diethylene glycol 355.36
    diisopropyl ether 92.0
    tert-amyl alcohol 518.77
    acetylacetone 630.78
    n-hexadecane 4.0
    acetophenone 240.56
    methyl propionate 499.81
    isopentyl acetate 308.67
    trichloroethylene 1677.0
    n-nonanol 92.56
    cyclohexanol 601.81
    benzyl alcohol 276.92
    2-ethylhexanol 144.02
    isooctanol 107.43
    dipropyl ether 141.02
    1,2-dichlorobenzene 274.78
    ethyl lactate 157.91
    propylene carbonate 494.46
    n-methylformamide 508.31
    2-pentanol 440.86
    n-pentane 12.8
    1-propoxy-2-propanol 416.39
    1-methoxy-2-propyl acetate 364.18
    2-(2-methoxypropoxy) propanol 251.09
    mesitylene 81.27
    ε-caprolactone 699.61
    p-cymene 50.91
    epichlorohydrin 1568.67
    1,1,1-trichloroethane 684.39
    2-aminoethanol 293.82
    morpholine-4-carbaldehyde 723.39
    sulfolane 944.34
    2,2,4-trimethylpentane 11.08
    2-methyltetrahydrofuran 1188.94
    n-hexyl acetate 250.89
    isooctane 8.48
    2-(2-butoxyethoxy)ethanol 460.21
    sec-butyl acetate 217.55
    tert-butyl acetate 341.45
    decalin 15.44
    glycerin 229.74
    diglyme 791.65
    acrylic acid 254.76
    isopropyl myristate 75.56
    n-butyric acid 844.19
    acetyl acetate 366.95
    di(2-ethylhexyl) phthalate 92.03
    ethyl propionate 272.81
    nitromethane 1120.69
    1,2-diethoxyethane 425.95
    benzonitrile 308.39
    trioctyl phosphate 66.12
    1-bromopropane 469.03
    gamma-valerolactone 1341.52
    n-decanol 64.34
    triethyl phosphate 87.55
    4-methyl-2-pentanol 172.87
    propionitrile 466.76
    vinylene carbonate 377.73
    1,1,2-trichlorotrifluoroethane 706.52
    DMS 192.38
    cumene 58.91
    2-octanol 80.29
    2-hexanone 369.66
    octyl acetate 109.49
    limonene 82.74
    1,2-dimethoxyethane 868.09
    ethyl orthosilicate 88.11
    tributyl phosphate 80.67
    diacetone alcohol 444.81
    N,N-dimethylaniline 136.4
    acrylonitrile 459.53
    aniline 472.86
    1,3-propanediol 588.02
    bromobenzene 375.25
    dibromomethane 838.49
    1,1,2,2-tetrachloroethane 1376.1
    2-methyl-cyclohexyl acetate 172.27
    tetrabutyl urea 101.19
    diisobutyl methanol 70.83
    2-phenylethanol 251.55
    styrene 134.04
    dioctyl adipate 128.72
    dimethyl sulfate 217.92
    ethyl butyrate 218.32
    methyl lactate 237.25
    butyl lactate 174.8
    diethyl carbonate 134.81
    propanediol butyl ether 299.56
    triethyl orthoformate 148.1
    p-tert-butyltoluene 51.97
    methyl 4-tert-butylbenzoate 178.47
    morpholine 2038.29
    tert-butylamine 316.58
    n-dodecanol 46.27
    dimethoxymethane 748.73
    ethylene carbonate 355.46
    cyrene 216.61
    2-ethoxyethyl acetate 314.16
    2-ethylhexyl acetate 217.06
    1,2,4-trichlorobenzene 348.12
    4-methylpyridine 806.96
    dibutyl ether 112.65
    2,6-dimethyl-4-heptanol 70.83
    DEF 566.36
    dimethyl isosorbide 396.76
    tetrachloroethylene 648.9
    eugenol 194.62
    triacetin 217.67
    span 80 228.65
    1,4-butanediol 171.58
    1,1-dichloroethane 1011.95
    2-methyl-1-pentanol 361.27
    methyl formate 338.28
    2-methyl-1-butanol 528.12
    n-decane 5.88
    butyronitrile 610.4
    3,7-dimethyl-1-octanol 102.67
    1-chlorooctane 50.74
    1-chlorotetradecane 16.91
    n-nonane 4.96
    undecane 4.28
    tert-butylcyclohexane 13.41
    cyclooctane 8.35
    cyclopentanol 556.72
    tetrahydropyran 1572.71
    tert-amyl methyl ether 263.8
    2,5,8-trioxanonane 447.23
    1-hexene 90.59
    2-isopropoxyethanol 348.59
    2,2,2-trifluoroethanol 135.79
    methyl butyrate 410.74

    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