Bis-ethylhexyl hydroxydimethoxy benzylmalonate

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  • Identifiers

    CAS number
    872182-46-2

    Molecular formula
    C28H46O7

    SMILES
    CCCCC(CC)COC(=O)C(CC1=CC(=C(C(=C1)OC)O)OC)C(=O)OCC(CC)CCCC

    Safety labels

  • Odor profile

    Fragrance
    Fruity 47.14%
    Herbal 39.18%
    Woody 31.83%
    Odorless 30.55%
    Spicy 29.91%
    Floral 29.8%
    Oily 29.33%
    Balsamic 28.8%
    Warm 25.02%
    Mint 24.87%

     

    Flavor
    Bland 32.22%
    Mild 26.73%
    Odorless 24.9%
    Bitter 24.66%
    Waxy 23.54%
    Oily 21.39%
    Herbal 21.11%
    Parsley 20.72%
    Cedarleaf 20.16%
    Heather 20.11%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    8.0

    pKa est.
    8.74 (weak base)

    Molecular weight
    494.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    578°C

    Flash point

    • 191.83 ˚C est.

  • Synonyms

    • Ronacare AP
    • Bis-ethylhexyl hydroxydimethoxy benzylmalonate
    • 7D4Q5YJ8NV
    • Propanedioic acid, ((4-hydroxy-3,5-dimethoxyphenyl)methyl)-, bis(2-ethylhexyl) ester
    • Propanedioic acid, 2-((4-hydroxy-3,5-dimethoxyphenyl)methyl)-, 1,3-bis(2-ethylhexyl) ester
    • Propanedioic acid, 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-, 1,3-bis(2-ethylhexyl) ester
    • RefChem:569399
    • (+-)-BIS-ETHYLHEXYL HYDROXYDIMETHOXY BENZYLMALONATE
    • BIS-ETHYLHEXYL HYDROXYDIMETHOXY BENZYLMALONATE [INCI]
    • UNII-7D4Q5YJ8NV
    • 872182-46-2
    • (+/-)-Bis-ethylhexyl hydroxydimethoxy benzylmalonate
    • SCHEMBL167005
    • QHQPFWCUOFWVKE-UHFFFAOYSA-N
    • DTXSID401007429
    • EX-A9690
    • 1,3-Bis(2-ethylhexyl) 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]propanedioate
    • NS00077858
    • Q27268097
    • Bis(2-ethylhexyl) [(4-hydroxy-3,5-dimethoxyphenyl)methyl]propanedioate
    • 872182-46-2

  • Applications

    Chemical name: Bis-ethylhexyl hydroxydimethoxy benzylmalonate - CAS number: 872182-46-2. Bis-ethylhexyl hydroxydimethoxy benzylmalonate is used as an intermediate and processing aid in polymer and coating formulations; it can function as a plasticizer for polymers and resins, helping improve flexibility and compatibility with other additives. In industrial manufacturing, it may serve as a stabilizer or compatibilizer in polymer blends and as a solvent or co-solvent in specialty formulations; it can also be a precursor for the synthesis of specialty esters and surfactants. In coatings and inks, it acts as a processing aid or additive to adjust rheology and gloss, and in adhesive formulations it may contribute to system compatibility and flexibility.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 170.67
    methanol 138.74
    isopropanol 178.08
    water 0.68
    ethyl acetate 360.94
    n-propanol 203.69
    acetone 773.63
    n-butanol 154.64
    acetonitrile 232.66
    DMF 393.92
    toluene 130.63
    isobutanol 153.27
    1,4-dioxane 417.93
    methyl acetate 387.27
    THF 909.49
    2-butanone 538.44
    n-pentanol 153.14
    sec-butanol 219.45
    n-hexane 15.0
    ethylene glycol 28.32
    NMP 552.93
    cyclohexane 48.16
    DMSO 1070.04
    n-butyl acetate 147.37
    n-octanol 60.23
    chloroform 714.73
    n-propyl acetate 200.01
    acetic acid 483.77
    dichloromethane 774.19
    cyclohexanone 717.13
    propylene glycol 63.03
    isopropyl acetate 219.4
    DMAc 667.54
    2-ethoxyethanol 237.7
    isopentanol 135.03
    n-heptane 7.52
    ethyl formate 189.74
    1,2-dichloroethane 639.56
    n-hexanol 87.84
    2-methoxyethanol 252.79
    isobutyl acetate 117.03
    tetrachloromethane 181.5
    n-pentyl acetate 191.52
    transcutol 394.75
    n-heptanol 72.08
    ethylbenzene 66.91
    MIBK 176.01
    2-propoxyethanol 164.33
    tert-butanol 224.1
    MTBE 212.47
    2-butoxyethanol 157.18
    propionic acid 272.89
    o-xylene 92.42
    formic acid 98.49
    diethyl ether 188.39
    m-xylene 69.97
    p-xylene 102.36
    chlorobenzene 216.89
    dimethyl carbonate 162.34
    n-octane 6.6
    formamide 185.95
    cyclopentanone 805.07
    2-pentanone 352.43
    anisole 127.87
    cyclopentyl methyl ether 236.96
    gamma-butyrolactone 717.78
    1-methoxy-2-propanol 196.18
    pyridine 385.55
    3-pentanone 312.05
    furfural 404.02
    n-dodecane 5.0
    diethylene glycol 107.78
    diisopropyl ether 55.45
    tert-amyl alcohol 245.44
    acetylacetone 523.94
    n-hexadecane 5.82
    acetophenone 183.49
    methyl propionate 281.12
    isopentyl acetate 143.7
    trichloroethylene 928.86
    n-nonanol 59.74
    cyclohexanol 215.15
    benzyl alcohol 140.93
    2-ethylhexanol 52.4
    isooctanol 65.0
    dipropyl ether 57.78
    1,2-dichlorobenzene 205.27
    ethyl lactate 99.65
    propylene carbonate 350.31
    n-methylformamide 213.21
    2-pentanol 118.79
    n-pentane 14.49
    1-propoxy-2-propanol 110.92
    1-methoxy-2-propyl acetate 159.34
    2-(2-methoxypropoxy) propanol 125.22
    mesitylene 45.49
    ε-caprolactone 483.01
    p-cymene 36.52
    epichlorohydrin 750.6
    1,1,1-trichloroethane 657.88
    2-aminoethanol 76.37
    morpholine-4-carbaldehyde 350.27
    sulfolane 936.05
    2,2,4-trimethylpentane 13.5
    2-methyltetrahydrofuran 472.99
    n-hexyl acetate 174.18
    isooctane 5.77
    2-(2-butoxyethoxy)ethanol 163.83
    sec-butyl acetate 137.13
    tert-butyl acetate 230.25
    decalin 18.89
    glycerin 77.89
    diglyme 305.67
    acrylic acid 217.1
    isopropyl myristate 57.53
    n-butyric acid 315.5
    acetyl acetate 308.22
    di(2-ethylhexyl) phthalate 76.26
    ethyl propionate 178.8
    nitromethane 780.03
    1,2-diethoxyethane 166.39
    benzonitrile 150.05
    trioctyl phosphate 56.17
    1-bromopropane 285.44
    gamma-valerolactone 733.88
    n-decanol 41.35
    triethyl phosphate 76.31
    4-methyl-2-pentanol 63.18
    propionitrile 179.96
    vinylene carbonate 276.55
    1,1,2-trichlorotrifluoroethane 451.53
    DMS 178.88
    cumene 44.7
    2-octanol 57.5
    2-hexanone 222.57
    octyl acetate 87.43
    limonene 55.46
    1,2-dimethoxyethane 313.46
    ethyl orthosilicate 69.49
    tributyl phosphate 64.02
    diacetone alcohol 252.1
    N,N-dimethylaniline 85.68
    acrylonitrile 198.56
    aniline 152.53
    1,3-propanediol 140.51
    bromobenzene 222.91
    dibromomethane 522.15
    1,1,2,2-tetrachloroethane 775.45
    2-methyl-cyclohexyl acetate 106.04
    tetrabutyl urea 88.04
    diisobutyl methanol 33.63
    2-phenylethanol 100.01
    styrene 80.1
    dioctyl adipate 104.54
    dimethyl sulfate 313.75
    ethyl butyrate 109.91
    methyl lactate 136.86
    butyl lactate 124.67
    diethyl carbonate 87.06
    propanediol butyl ether 118.56
    triethyl orthoformate 82.04
    p-tert-butyltoluene 33.55
    methyl 4-tert-butylbenzoate 151.99
    morpholine 440.59
    tert-butylamine 99.11
    n-dodecanol 30.22
    dimethoxymethane 281.11
    ethylene carbonate 268.42
    cyrene 174.64
    2-ethoxyethyl acetate 258.22
    2-ethylhexyl acetate 108.43
    1,2,4-trichlorobenzene 265.54
    4-methylpyridine 286.63
    dibutyl ether 66.72
    2,6-dimethyl-4-heptanol 33.63
    DEF 279.68
    dimethyl isosorbide 206.27
    tetrachloroethylene 492.56
    eugenol 135.37
    triacetin 205.79
    span 80 119.84
    1,4-butanediol 82.82
    1,1-dichloroethane 559.43
    2-methyl-1-pentanol 144.69
    methyl formate 205.25
    2-methyl-1-butanol 147.49
    n-decane 8.88
    butyronitrile 155.28
    3,7-dimethyl-1-octanol 56.21
    1-chlorooctane 47.92
    1-chlorotetradecane 19.05
    n-nonane 7.88
    undecane 6.33
    tert-butylcyclohexane 13.39
    cyclooctane 12.23
    cyclopentanol 269.81
    tetrahydropyran 445.56
    tert-amyl methyl ether 171.99
    2,5,8-trioxanonane 200.83
    1-hexene 54.27
    2-isopropoxyethanol 178.16
    2,2,2-trifluoroethanol 220.29
    methyl butyrate 232.79

    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