1,3,5-Tris(2,2-dimethylpropionylamino)benzene

Overview IFRA Request a quote

  • Identifiers

    CAS number
    745070-61-5

    Molecular formula
    C21H33N3O3

    SMILES
    CC(C)(C)C(=O)NC1=CC(=CC(=C1)NC(=O)C(C)(C)C)NC(=O)C(C)(C)C

    Safety labels

  • Odor profile

    Fragrance
    Cooling 30.91%
    Fruity 27.57%
    Odorless 27.44%
    Mint 26.68%
    Savory 24.14%
    Animal 23.32%
    Cheesy 23.1%
    Woody 22.96%
    Dry 22.39%
    Grapefruit 21.52%

     

    Flavor
    Bitter 39.15%
    Fruity 25.19%
    Odorless 22.55%
    Bland 21.12%
    Mild 20.19%
    Green pepper 19.73%
    Broom 19.42%
    Cedarleaf 19.21%
    Heather 19.12%
    Light 19.07%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.7

    pKa est.
    6.62 (neutral)

    Molecular weight
    375.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    568°C

    Flash point

    • 226.25 ˚C est.

  • Synonyms

    • 745070-61-5
    • 1,3,5-Tris(2,2-dimethylpropionylamino)benzene
    • N1YOS8E19Y
    • Propanamide, N,N',N''-1,3,5-benzenetriyltris(2,2-dimethyl-
    • Propanamide, N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-
    • IRGACLEAR XT 386
    • DTXSID6075437
    • CGX 386
    • N,N',N-1,3,5-BENZENETRIYLTRIS(2,2-DIMETHYLPROPANAMIDE)
    • N,N',N''-1,3,5-BENZENETRIYLTRIS(2,2-DI-METHYLPROPANAMIDE)
    • 1,3,5-Tris[2,2-dimethylpropionylamino]benzene
    • RefChem:412675
    • DTXCID7047697
    • 456-830-2
    • 616-108-1
    • UNII-N1YOS8E19Y
    • N-[3,5-bis(2,2-dimethylpropanoylamino)phenyl]-2,2-dimethylpropanamide
    • 1,3,5-TRIS(2,2-DIMETHYLPROPANAMIDO)BENZENE
    • Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-
    • SCHEMBL23441
    • CPEULHAPWXMDDV-UHFFFAOYSA-N
    • DB-301017
    • NS00076893
    • Q27284392
    • N,N',N''-(benzene-1,3,5-triyl)tris(2,2-dimethylpropanamide)
    • 745070-61-5

  • Applications

    1,3,5-Tris(2,2-dimethylpropionylamino)benzene is primarily used as a multifunctional intermediate in organic synthesis for specialty polymers and resin systems. It can act as a building block for customized, highly functional materials and, because of its three amide groups, as a multifunctional crosslinking component in coatings, inks, and adhesives to promote network formation. The compound is evaluated as a precursor for pharmaceutical and agrochemical intermediates in niche syntheses, with its exact role depending on formulation requirements and regulatory constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 225.76
    methanol 210.08
    isopropanol 204.81
    water 1.79
    ethyl acetate 357.66
    n-propanol 200.35
    acetone 652.87
    n-butanol 149.7
    acetonitrile 315.19
    DMF 1911.07
    toluene 95.55
    isobutanol 169.91
    1,4-dioxane 259.03
    methyl acetate 490.32
    THF 797.31
    2-butanone 561.4
    n-pentanol 152.69
    sec-butanol 225.95
    n-hexane 16.91
    ethylene glycol 62.6
    NMP 1706.18
    cyclohexane 7.74
    DMSO 1050.27
    n-butyl acetate 290.82
    n-octanol 89.95
    chloroform 1164.14
    n-propyl acetate 318.65
    acetic acid 663.04
    dichloromethane 860.06
    cyclohexanone 511.79
    propylene glycol 180.62
    isopropyl acetate 274.29
    DMAc 1960.17
    2-ethoxyethanol 372.67
    isopentanol 131.49
    n-heptane 7.96
    ethyl formate 326.27
    1,2-dichloroethane 466.81
    n-hexanol 129.38
    2-methoxyethanol 460.83
    isobutyl acetate 215.0
    tetrachloromethane 114.65
    n-pentyl acetate 218.58
    transcutol 656.84
    n-heptanol 98.11
    ethylbenzene 65.7
    MIBK 236.53
    2-propoxyethanol 393.9
    tert-butanol 203.79
    MTBE 242.91
    2-butoxyethanol 313.64
    propionic acid 426.14
    o-xylene 66.98
    formic acid 334.43
    diethyl ether 167.52
    m-xylene 63.12
    p-xylene 102.56
    chlorobenzene 171.81
    dimethyl carbonate 369.84
    n-octane 4.4
    formamide 514.81
    cyclopentanone 904.12
    2-pentanone 403.95
    anisole 186.31
    cyclopentyl methyl ether 296.46
    gamma-butyrolactone 1124.69
    1-methoxy-2-propanol 490.34
    pyridine 380.74
    3-pentanone 331.38
    furfural 872.31
    n-dodecane 2.75
    diethylene glycol 223.38
    diisopropyl ether 52.01
    tert-amyl alcohol 243.61
    acetylacetone 568.13
    n-hexadecane 3.2
    acetophenone 302.65
    methyl propionate 455.49
    isopentyl acetate 263.4
    trichloroethylene 1223.47
    n-nonanol 86.22
    cyclohexanol 136.04
    benzyl alcohol 189.99
    2-ethylhexanol 83.15
    isooctanol 80.83
    dipropyl ether 117.59
    1,2-dichlorobenzene 188.14
    ethyl lactate 271.05
    propylene carbonate 704.37
    n-methylformamide 768.74
    2-pentanol 137.97
    n-pentane 12.1
    1-propoxy-2-propanol 336.46
    1-methoxy-2-propyl acetate 402.66
    2-(2-methoxypropoxy) propanol 297.18
    mesitylene 31.58
    ε-caprolactone 563.45
    p-cymene 42.14
    epichlorohydrin 1001.08
    1,1,1-trichloroethane 504.44
    2-aminoethanol 157.15
    morpholine-4-carbaldehyde 1106.98
    sulfolane 1556.2
    2,2,4-trimethylpentane 9.87
    2-methyltetrahydrofuran 439.53
    n-hexyl acetate 275.36
    isooctane 4.24
    2-(2-butoxyethoxy)ethanol 333.49
    sec-butyl acetate 222.19
    tert-butyl acetate 294.86
    decalin 8.32
    glycerin 240.63
    diglyme 618.24
    acrylic acid 461.58
    isopropyl myristate 78.58
    n-butyric acid 429.97
    acetyl acetate 271.94
    di(2-ethylhexyl) phthalate 113.39
    ethyl propionate 294.39
    nitromethane 1511.39
    1,2-diethoxyethane 205.47
    benzonitrile 198.23
    trioctyl phosphate 81.6
    1-bromopropane 226.01
    gamma-valerolactone 1233.98
    n-decanol 56.61
    triethyl phosphate 140.48
    4-methyl-2-pentanol 79.0
    propionitrile 217.73
    vinylene carbonate 580.5
    1,1,2-trichlorotrifluoroethane 1051.1
    DMS 335.66
    cumene 49.83
    2-octanol 67.84
    2-hexanone 317.99
    octyl acetate 121.72
    limonene 56.48
    1,2-dimethoxyethane 526.14
    ethyl orthosilicate 119.29
    tributyl phosphate 114.24
    diacetone alcohol 384.91
    N,N-dimethylaniline 195.24
    acrylonitrile 332.87
    aniline 167.43
    1,3-propanediol 179.16
    bromobenzene 160.02
    dibromomethane 489.57
    1,1,2,2-tetrachloroethane 973.74
    2-methyl-cyclohexyl acetate 182.27
    tetrabutyl urea 152.96
    diisobutyl methanol 40.98
    2-phenylethanol 167.73
    styrene 73.74
    dioctyl adipate 152.99
    dimethyl sulfate 845.09
    ethyl butyrate 224.04
    methyl lactate 419.2
    butyl lactate 270.06
    diethyl carbonate 157.28
    propanediol butyl ether 310.79
    triethyl orthoformate 171.97
    p-tert-butyltoluene 40.86
    methyl 4-tert-butylbenzoate 328.08
    morpholine 443.96
    tert-butylamine 100.1
    n-dodecanol 36.3
    dimethoxymethane 596.26
    ethylene carbonate 417.51
    cyrene 374.48
    2-ethoxyethyl acetate 319.24
    2-ethylhexyl acetate 199.19
    1,2,4-trichlorobenzene 284.4
    4-methylpyridine 451.43
    dibutyl ether 87.74
    2,6-dimethyl-4-heptanol 40.98
    DEF 592.87
    dimethyl isosorbide 465.19
    tetrachloroethylene 463.44
    eugenol 274.79
    triacetin 386.94
    span 80 260.27
    1,4-butanediol 108.51
    1,1-dichloroethane 541.44
    2-methyl-1-pentanol 135.04
    methyl formate 609.46
    2-methyl-1-butanol 161.17
    n-decane 6.23
    butyronitrile 200.64
    3,7-dimethyl-1-octanol 82.89
    1-chlorooctane 46.12
    1-chlorotetradecane 12.87
    n-nonane 5.74
    undecane 3.98
    tert-butylcyclohexane 10.1
    cyclooctane 3.15
    cyclopentanol 222.27
    tetrahydropyran 235.59
    tert-amyl methyl ether 221.92
    2,5,8-trioxanonane 354.78
    1-hexene 75.94
    2-isopropoxyethanol 276.16
    2,2,2-trifluoroethanol 437.29
    methyl butyrate 411.72

    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