Npc276861

Overview IFRA Request a quote

  • Identifiers

    CAS number
    56797-43-4

    Molecular formula
    C16H26O

    SMILES
    CC/C=C\C/C=C\C/C=C\CCCCCC=O

    Safety labels

  • Odor profile

    Fragrance
    Fatty 72.67%
    Oily 48.53%
    Citrus 48.11%
    Waxy 40.79%
    Fruity 34.53%
    Herbal 32.14%
    Fishy 31.89%
    Aldehydic 28.87%
    Fresh 27.64%
    Green 26.7%

     

    Flavor
    Fatty 20.49%
    Pumpkin 19.51%
    Oriental 19.25%
    Citrus 19.06%
    Honeydew 18.88%
    Biscuit 18.3%
    Low 18.25%
    Diterpene 18.2%
    Delicate 18.15%
    Dewy 18.04%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.7

    pKa est.
    7.23 (neutral)

    Molecular weight
    234.38 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    277°C

    Flash point

    • 167.77 ˚C est.

  • Synonyms

    • RefChem:1093006
    • Npc276861
    • cis,cis,cis-7,10,13-Hexadecatrienal
    • (7Z,10Z,13Z)-hexadeca-7,10,13-trienal
    • (7Z,10Z,13Z)-7,10,13-Hexadecatrienal
    • USMAGXMGZXKLHT-PDBXOOCHSA-N
    • (7Z,10Z,13Z)-7,10,13-Hexadecatrienal #
    • 56797-43-4
    • 56797-43-4

  • Applications

    Npc276861 may find use as an intermediate in organic synthesis; as a solvent or processing aid in industrial manufacturing; as a stabilizer or plasticizer for polymers and plastics; as an additive in coatings and inks to improve performance and stability; and in cleaning formulations as a solvent or dissolving agent, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 464.42
    methanol 369.7
    isopropanol 393.0
    water 0.01
    ethyl acetate 776.4
    n-propanol 399.84
    acetone 768.67
    n-butanol 442.79
    acetonitrile 254.72
    DMF 389.01
    toluene 289.79
    isobutanol 289.65
    1,4-dioxane 838.86
    methyl acetate 378.73
    THF 1643.17
    2-butanone 680.75
    n-pentanol 338.34
    sec-butanol 361.48
    n-hexane 209.09
    ethylene glycol 20.78
    NMP 384.33
    cyclohexane 400.91
    DMSO 1028.56
    n-butyl acetate 718.01
    n-octanol 121.77
    chloroform 1141.71
    n-propyl acetate 648.91
    acetic acid 189.34
    dichloromethane 1351.46
    cyclohexanone 991.97
    propylene glycol 61.09
    isopropyl acetate 517.79
    DMAc 410.7
    2-ethoxyethanol 416.4
    isopentanol 425.77
    n-heptane 136.47
    ethyl formate 234.21
    1,2-dichloroethane 1221.13
    n-hexanol 386.5
    2-methoxyethanol 502.33
    isobutyl acetate 388.81
    tetrachloromethane 218.21
    n-pentyl acetate 373.25
    transcutol 2024.21
    n-heptanol 135.79
    ethylbenzene 190.3
    MIBK 506.65
    2-propoxyethanol 516.21
    tert-butanol 499.54
    MTBE 688.35
    2-butoxyethanol 284.39
    propionic acid 182.39
    o-xylene 176.41
    formic acid 27.78
    diethyl ether 1135.66
    m-xylene 201.78
    p-xylene 207.32
    chlorobenzene 357.4
    dimethyl carbonate 88.71
    n-octane 35.64
    formamide 55.57
    cyclopentanone 861.12
    2-pentanone 796.76
    anisole 328.66
    cyclopentyl methyl ether 829.49
    gamma-butyrolactone 683.1
    1-methoxy-2-propanol 488.98
    pyridine 678.54
    3-pentanone 487.49
    furfural 496.71
    n-dodecane 18.79
    diethylene glycol 196.06
    diisopropyl ether 285.49
    tert-amyl alcohol 390.46
    acetylacetone 624.21
    n-hexadecane 22.35
    acetophenone 317.24
    methyl propionate 400.21
    isopentyl acetate 596.51
    trichloroethylene 1436.77
    n-nonanol 123.44
    cyclohexanol 432.74
    benzyl alcohol 218.38
    2-ethylhexanol 304.35
    isooctanol 143.93
    dipropyl ether 734.7
    1,2-dichlorobenzene 350.0
    ethyl lactate 157.77
    propylene carbonate 386.11
    n-methylformamide 145.5
    2-pentanol 351.69
    n-pentane 126.95
    1-propoxy-2-propanol 499.47
    1-methoxy-2-propyl acetate 513.14
    2-(2-methoxypropoxy) propanol 284.14
    mesitylene 147.86
    ε-caprolactone 688.39
    p-cymene 131.19
    epichlorohydrin 1128.38
    1,1,1-trichloroethane 828.08
    2-aminoethanol 86.05
    morpholine-4-carbaldehyde 478.62
    sulfolane 806.7
    2,2,4-trimethylpentane 53.37
    2-methyltetrahydrofuran 1192.1
    n-hexyl acetate 399.63
    isooctane 49.46
    2-(2-butoxyethoxy)ethanol 414.36
    sec-butyl acetate 443.57
    tert-butyl acetate 554.05
    decalin 106.22
    glycerin 73.3
    diglyme 883.53
    acrylic acid 99.95
    isopropyl myristate 163.75
    n-butyric acid 492.44
    acetyl acetate 315.5
    di(2-ethylhexyl) phthalate 113.87
    ethyl propionate 497.62
    nitromethane 352.54
    1,2-diethoxyethane 1016.34
    benzonitrile 281.78
    trioctyl phosphate 88.06
    1-bromopropane 946.62
    gamma-valerolactone 921.72
    n-decanol 89.63
    triethyl phosphate 187.56
    4-methyl-2-pentanol 204.58
    propionitrile 302.86
    vinylene carbonate 270.6
    1,1,2-trichlorotrifluoroethane 490.44
    DMS 230.36
    cumene 127.71
    2-octanol 100.82
    2-hexanone 643.1
    octyl acetate 176.65
    limonene 247.17
    1,2-dimethoxyethane 897.36
    ethyl orthosilicate 205.23
    tributyl phosphate 123.98
    diacetone alcohol 446.74
    N,N-dimethylaniline 212.08
    acrylonitrile 243.13
    aniline 245.69
    1,3-propanediol 181.17
    bromobenzene 432.26
    dibromomethane 1050.18
    1,1,2,2-tetrachloroethane 1272.61
    2-methyl-cyclohexyl acetate 362.7
    tetrabutyl urea 164.54
    diisobutyl methanol 201.39
    2-phenylethanol 237.36
    styrene 249.63
    dioctyl adipate 236.9
    dimethyl sulfate 151.42
    ethyl butyrate 557.13
    methyl lactate 114.32
    butyl lactate 229.61
    diethyl carbonate 280.32
    propanediol butyl ether 206.19
    triethyl orthoformate 363.11
    p-tert-butyltoluene 122.86
    methyl 4-tert-butylbenzoate 243.6
    morpholine 1155.49
    tert-butylamine 360.41
    n-dodecanol 69.37
    dimethoxymethane 496.92
    ethylene carbonate 274.39
    cyrene 220.91
    2-ethoxyethyl acetate 453.62
    2-ethylhexyl acetate 470.97
    1,2,4-trichlorobenzene 365.57
    4-methylpyridine 599.42
    dibutyl ether 488.65
    2,6-dimethyl-4-heptanol 201.39
    DEF 600.51
    dimethyl isosorbide 540.6
    tetrachloroethylene 773.23
    eugenol 210.44
    triacetin 330.7
    span 80 252.36
    1,4-butanediol 68.22
    1,1-dichloroethane 955.45
    2-methyl-1-pentanol 313.54
    methyl formate 92.27
    2-methyl-1-butanol 341.69
    n-decane 39.08
    butyronitrile 477.03
    3,7-dimethyl-1-octanol 177.29
    1-chlorooctane 161.43
    1-chlorotetradecane 53.14
    n-nonane 41.98
    undecane 25.62
    tert-butylcyclohexane 84.54
    cyclooctane 99.46
    cyclopentanol 318.68
    tetrahydropyran 1562.64
    tert-amyl methyl ether 465.75
    2,5,8-trioxanonane 536.62
    1-hexene 512.68
    2-isopropoxyethanol 322.7
    2,2,2-trifluoroethanol 40.56
    methyl butyrate 650.4

    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