N-Nonan-2-ylidenehydroxylamine

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  • Identifiers

    CAS number
    112630-67-8

    Molecular formula
    C9H19NO

    SMILES
    CCCCCCCC(=NO)C

  • Odor profile

    Fragrance
    Green 83.75%
    Floral 81.15%
    Fresh 67.45%
    Citrus 52.55%
    Aldehydic 45.35%
    Waxy 40.83%
    Rose 38.59%
    Muguet 36.73%
    Lily 35.33%
    Leafy 34.95%

     

    Flavor
    Herbal 42.65%
    Floral 41.92%
    Green 41.91%
    Fatty 38.54%
    Waxy 36.08%
    Citrus 33.11%
    Fresh 31.81%
    Earthy 30.61%
    Mushroom 30.04%
    Fat 29.82%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    10.11 (weak base)

    Molecular weight
    157.25 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    230°C

    Flash point

    • 101.25 ˚C est.

  • Synonyms

    • N-Nonan-2-ylidenehydroxylamine
    • 112630-67-8
    • DTXSID30764426
    • Nonanonoxim
    • DTXCID20715169
    • AKOS017271106

  • Applications

    N-Nonan-2-ylidenehydroxylamine (CAS number: 112630-67-8) is a reagent and intermediate in organic synthesis, providing nitrogen-containing groups for nitrene-transfer-type reactions and iminium formation, enabling the construction of amines and heterocyclic rings. It is commonly encountered as a reactive intermediate in routes toward pharmaceuticals and fine chemicals. In polymer and materials science, it may be evaluated for post-polymerization functionalization or as a nitrogen source for functional material design. In research and process development settings, it can serve as a building block for ligand design and the development of new functional materials, with use subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2970.93
    methanol 2746.2
    isopropanol 2943.03
    water 0.05
    ethyl acetate 2413.89
    n-propanol 2324.12
    acetone 4469.48
    n-butanol 2210.11
    acetonitrile 1782.33
    DMF 2233.13
    toluene 794.06
    isobutanol 1697.9
    1,4-dioxane 2342.68
    methyl acetate 1510.2
    THF 4152.25
    2-butanone 2849.31
    n-pentanol 1528.37
    sec-butanol 1995.32
    n-hexane 732.31
    ethylene glycol 164.53
    NMP 1414.82
    cyclohexane 581.25
    DMSO 3457.76
    n-butyl acetate 2662.07
    n-octanol 593.53
    chloroform 3613.68
    n-propyl acetate 1836.61
    acetic acid 1315.05
    dichloromethane 3342.23
    cyclohexanone 3813.08
    propylene glycol 403.75
    isopropyl acetate 1564.07
    DMAc 1118.32
    2-ethoxyethanol 1389.02
    isopentanol 2028.51
    n-heptane 249.34
    ethyl formate 1086.59
    1,2-dichloroethane 2555.5
    n-hexanol 1819.3
    2-methoxyethanol 2149.5
    isobutyl acetate 1048.27
    tetrachloromethane 676.06
    n-pentyl acetate 1213.44
    transcutol 6228.42
    n-heptanol 624.69
    ethylbenzene 528.76
    MIBK 1375.03
    2-propoxyethanol 2032.95
    tert-butanol 3248.93
    MTBE 2819.03
    2-butoxyethanol 1062.17
    propionic acid 1129.65
    o-xylene 485.6
    formic acid 233.49
    diethyl ether 2926.05
    m-xylene 610.93
    p-xylene 665.61
    chlorobenzene 1166.74
    dimethyl carbonate 238.13
    n-octane 89.12
    formamide 377.52
    cyclopentanone 3302.92
    2-pentanone 2716.31
    anisole 816.21
    cyclopentyl methyl ether 2221.22
    gamma-butyrolactone 2669.17
    1-methoxy-2-propanol 1987.91
    pyridine 2186.94
    3-pentanone 1361.99
    furfural 1715.27
    n-dodecane 45.22
    diethylene glycol 895.11
    diisopropyl ether 766.59
    tert-amyl alcohol 2082.67
    acetylacetone 1781.28
    n-hexadecane 54.45
    acetophenone 749.2
    methyl propionate 1207.71
    isopentyl acetate 2110.32
    trichloroethylene 4043.36
    n-nonanol 492.03
    cyclohexanol 1766.25
    benzyl alcohol 676.46
    2-ethylhexanol 1153.71
    isooctanol 560.66
    dipropyl ether 1599.28
    1,2-dichlorobenzene 950.39
    ethyl lactate 413.63
    propylene carbonate 1257.8
    n-methylformamide 1034.23
    2-pentanol 1652.37
    n-pentane 363.96
    1-propoxy-2-propanol 1944.05
    1-methoxy-2-propyl acetate 1537.89
    2-(2-methoxypropoxy) propanol 802.34
    mesitylene 378.73
    ε-caprolactone 2416.3
    p-cymene 340.48
    epichlorohydrin 3029.84
    1,1,1-trichloroethane 2609.82
    2-aminoethanol 561.3
    morpholine-4-carbaldehyde 1562.51
    sulfolane 2701.5
    2,2,4-trimethylpentane 140.43
    2-methyltetrahydrofuran 3684.01
    n-hexyl acetate 1339.98
    isooctane 132.4
    2-(2-butoxyethoxy)ethanol 1342.82
    sec-butyl acetate 1129.88
    tert-butyl acetate 1592.09
    decalin 227.59
    glycerin 430.58
    diglyme 2335.1
    acrylic acid 673.81
    isopropyl myristate 415.09
    n-butyric acid 2478.21
    acetyl acetate 828.93
    di(2-ethylhexyl) phthalate 308.16
    ethyl propionate 1204.08
    nitromethane 1897.72
    1,2-diethoxyethane 2520.93
    benzonitrile 1122.46
    trioctyl phosphate 254.85
    1-bromopropane 2252.39
    gamma-valerolactone 3270.96
    n-decanol 340.49
    triethyl phosphate 351.86
    4-methyl-2-pentanol 838.75
    propionitrile 1679.12
    vinylene carbonate 991.31
    1,1,2-trichlorotrifluoroethane 1652.73
    DMS 630.32
    cumene 339.78
    2-octanol 494.34
    2-hexanone 2103.8
    octyl acetate 491.13
    limonene 655.6
    1,2-dimethoxyethane 2707.32
    ethyl orthosilicate 393.15
    tributyl phosphate 371.46
    diacetone alcohol 1472.49
    N,N-dimethylaniline 507.02
    acrylonitrile 1572.16
    aniline 949.24
    1,3-propanediol 1047.27
    bromobenzene 1281.23
    dibromomethane 2744.0
    1,1,2,2-tetrachloroethane 3222.0
    2-methyl-cyclohexyl acetate 807.26
    tetrabutyl urea 436.62
    diisobutyl methanol 628.25
    2-phenylethanol 791.07
    styrene 684.24
    dioctyl adipate 543.66
    dimethyl sulfate 418.77
    ethyl butyrate 1349.65
    methyl lactate 421.41
    butyl lactate 767.61
    diethyl carbonate 613.09
    propanediol butyl ether 962.53
    triethyl orthoformate 759.65
    p-tert-butyltoluene 339.24
    methyl 4-tert-butylbenzoate 552.99
    morpholine 3502.79
    tert-butylamine 2079.64
    n-dodecanol 242.06
    dimethoxymethane 1362.98
    ethylene carbonate 905.51
    cyrene 530.8
    2-ethoxyethyl acetate 1308.26
    2-ethylhexyl acetate 1499.73
    1,2,4-trichlorobenzene 1036.21
    4-methylpyridine 2284.67
    dibutyl ether 1431.63
    2,6-dimethyl-4-heptanol 628.25
    DEF 2034.39
    dimethyl isosorbide 1256.08
    tetrachloroethylene 2143.33
    eugenol 585.65
    triacetin 801.24
    span 80 829.92
    1,4-butanediol 413.28
    1,1-dichloroethane 3178.0
    2-methyl-1-pentanol 1309.69
    methyl formate 635.8
    2-methyl-1-butanol 1568.25
    n-decane 101.1
    butyronitrile 2321.46
    3,7-dimethyl-1-octanol 709.15
    1-chlorooctane 490.55
    1-chlorotetradecane 141.76
    n-nonane 113.7
    undecane 64.72
    tert-butylcyclohexane 232.05
    cyclooctane 149.49
    cyclopentanol 1707.98
    tetrahydropyran 4220.33
    tert-amyl methyl ether 1507.91
    2,5,8-trioxanonane 1274.9
    1-hexene 2319.17
    2-isopropoxyethanol 1114.0
    2,2,2-trifluoroethanol 251.63
    methyl butyrate 1902.52

    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