3-Nonenoic acid, (3Z)-

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    41653-98-9

    Molecular formula
    C9H16O2

    SMILES
    CCCCC/C=C\CC(=O)O

  • Odor profile

    Green 89.07%
    Fatty 87.15%
    Fruity 83.92%
    Waxy 75.91%
    Dairy 63.25%
    Melon 50.16%
    Oily 49.98%
    Milky 38.72%
    Cheesy 38.67%
    Pear 33.38%

    Scent© AI

  • Properties

    XLogP3-AA
    2.8

    pKa est.
    8.19 (weak base)

    Molecular weight
    156.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    250°C

    Flash point est.
    125.96 ˚C

  • Synonyms

    • 3Z-nonenoic acid
    • cis-3-Nonenoic acid
    • 3-Nonenoic acid, (Z)-
    • 3-Nonenoic acid, (3Z)-
    • UNII-2PH40QU00W
    • 2PH40QU00W
    • (Z)-non-3-enoic acid
    • 41653-98-9
    • C9:1n-6
    • xi-3-Nonenoic acid
    • (3Z)-3-nonenoic acid
    • SCHEMBL5370778
    • CHEBI:195759
    • LMFA01030444
    • Q27255417

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1834.09
    methanol 2284.66
    isopropanol 1205.26
    water 0.49
    ethyl acetate 532.07
    n-propanol 1164.43
    acetone 1422.02
    n-butanol 986.94
    acetonitrile 272.81
    DMF 2049.31
    toluene 98.48
    isobutanol 806.69
    1,4-dioxane 663.29
    methyl acetate 346.51
    THF 1871.07
    2-butanone 686.44
    n-pentanol 753.08
    sec-butanol 767.8
    n-hexane 143.31
    ethylene glycol 406.68
    NMP 1062.22
    cyclohexane 49.58
    DMSO 2833.84
    n-butyl acetate 503.2
    n-octanol 220.06
    chloroform 269.18
    n-propyl acetate 395.34
    acetic acid 762.87
    dichloromethane 249.52
    cyclohexanone 848.64
    propylene glycol 653.5
    isopropyl acetate 411.06
    DMAc 876.49
    2-ethoxyethanol 846.17
    isopentanol 847.92
    n-heptane 37.2
    ethyl formate 248.73
    1,2-dichloroethane 313.26
    n-hexanol 775.36
    2-methoxyethanol 1549.18
    isobutyl acetate 275.47
    tetrachloromethane 59.47
    n-pentyl acetate 227.89
    transcutol 2261.43
    n-heptanol 236.76
    ethylbenzene 84.9
    MIBK 495.62
    2-propoxyethanol 1016.18
    tert-butanol 1451.89
    MTBE 728.93
    2-butoxyethanol 442.57
    propionic acid 546.9
    o-xylene 91.92
    formic acid 278.72
    diethyl ether 486.07
    m-xylene 139.82
    p-xylene 102.04
    chlorobenzene 124.2
    dimethyl carbonate 134.4
    n-octane 12.92
    formamide 383.97
    cyclopentanone 1238.35
    2-pentanone 788.98
    anisole 229.86
    cyclopentyl methyl ether 867.96
    gamma-butyrolactone 993.08
    1-methoxy-2-propanol 1315.91
    pyridine 337.99
    3-pentanone 361.34
    furfural 525.21
    n-dodecane 9.36
    diethylene glycol 739.02
    diisopropyl ether 199.4
    tert-amyl alcohol 911.73
    acetylacetone 671.66
    n-hexadecane 10.54
    acetophenone 211.49
    methyl propionate 447.74
    isopentyl acetate 469.86
    trichloroethylene 450.73
    n-nonanol 177.67
    cyclohexanol 623.31
    benzyl alcohol 252.58
    2-ethylhexanol 348.12
    isooctanol 196.33
    dipropyl ether 310.15
    1,2-dichlorobenzene 123.86
    ethyl lactate 197.64
    propylene carbonate 407.29
    n-methylformamide 761.41
    2-pentanol 646.67
    n-pentane 58.59
    1-propoxy-2-propanol 758.16
    1-methoxy-2-propyl acetate 497.96
    2-(2-methoxypropoxy) propanol 396.04
    mesitylene 100.56
    ε-caprolactone 586.66
    p-cymene 60.87
    epichlorohydrin 879.22
    1,1,1-trichloroethane 243.3
    2-aminoethanol 945.31
    morpholine-4-carbaldehyde 795.09
    sulfolane 1380.83
    2,2,4-trimethylpentane 36.54
    2-methyltetrahydrofuran 1164.26
    n-hexyl acetate 363.61
    isooctane 41.02
    2-(2-butoxyethoxy)ethanol 636.64
    sec-butyl acetate 266.77
    tert-butyl acetate 539.5
    decalin 43.13
    glycerin 673.84
    diglyme 865.68
    acrylic acid 370.89
    isopropyl myristate 118.06
    n-butyric acid 827.98
    acetyl acetate 206.06
    di(2-ethylhexyl) phthalate 128.13
    ethyl propionate 302.07
    nitromethane 753.69
    1,2-diethoxyethane 510.23
    benzonitrile 204.25
    trioctyl phosphate 102.35
    1-bromopropane 207.18
    gamma-valerolactone 1055.97
    n-decanol 129.67
    triethyl phosphate 107.82
    4-methyl-2-pentanol 377.25
    propionitrile 299.69
    vinylene carbonate 269.71
    1,1,2-trichlorotrifluoroethane 647.52
    DMS 192.96
    cumene 77.3
    2-octanol 151.95
    2-hexanone 548.52
    octyl acetate 158.43
    limonene 120.48
    1,2-dimethoxyethane 1004.56
    ethyl orthosilicate 117.37
    tributyl phosphate 128.27
    diacetone alcohol 815.66
    N,N-dimethylaniline 179.53
    acrylonitrile 317.74
    aniline 256.11
    1,3-propanediol 969.24
    bromobenzene 110.23
    dibromomethane 200.75
    1,1,2,2-tetrachloroethane 458.66
    2-methyl-cyclohexyl acetate 226.17
    tetrabutyl urea 169.39
    diisobutyl methanol 179.1
    2-phenylethanol 279.1
    styrene 98.37
    dioctyl adipate 185.86
    dimethyl sulfate 271.03
    ethyl butyrate 264.53
    methyl lactate 307.21
    butyl lactate 246.14
    diethyl carbonate 137.67
    propanediol butyl ether 541.44
    triethyl orthoformate 185.65
    p-tert-butyltoluene 69.14
    methyl 4-tert-butylbenzoate 214.19
    morpholine 1152.52
    tert-butylamine 802.75
    n-dodecanol 92.97
    dimethoxymethane 850.4
    ethylene carbonate 241.46
    cyrene 305.88
    2-ethoxyethyl acetate 304.18
    2-ethylhexyl acetate 319.92
    1,2,4-trichlorobenzene 153.89
    4-methylpyridine 396.6
    dibutyl ether 226.79
    2,6-dimethyl-4-heptanol 179.1
    DEF 711.72
    dimethyl isosorbide 566.17
    tetrachloroethylene 302.37
    eugenol 238.92
    triacetin 264.9
    span 80 373.71
    1,4-butanediol 427.75
    1,1-dichloroethane 272.67
    2-methyl-1-pentanol 588.96
    methyl formate 351.32
    2-methyl-1-butanol 699.24
    n-decane 16.68
    butyronitrile 429.99
    3,7-dimethyl-1-octanol 232.91
    1-chlorooctane 86.13
    1-chlorotetradecane 30.36
    n-nonane 17.25
    undecane 12.12
    tert-butylcyclohexane 56.61
    cyclooctane 20.02
    cyclopentanol 832.91
    tetrahydropyran 801.13
    tert-amyl methyl ether 476.72
    2,5,8-trioxanonane 589.66
    1-hexene 415.59
    2-isopropoxyethanol 603.99
    2,2,2-trifluoroethanol 145.14
    methyl butyrate 427.02

    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

Botanical

Name CAS Botanical Proportion
Genet absolute 2 8023-80-1 Spartium junceum L., fam. Leguminosae (Papilionaceae) 0.03%