Dipropyl Malonate

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  • Identifiers

    CAS number
    1117-19-7

    Molecular formula
    C9H16O4

    SMILES
    CCCOC(=O)CC(=O)OCCC

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fruity 82.75%
    Winey 68.62%
    Apple 59.27%
    Ethereal 48.16%
    Green 36.75%
    Sweet 35.38%
    Fermented 33.99%
    Herbal 32.56%
    Oily 31.2%
    Brandy 29.59%

    Scent© AI

  • Properties

    XLogP3-AA
    2.0

    Molecular weight
    188.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    230°C

    Flash point est.
    92.47 ˚C

  • Synonyms

    • Dipropyl malonate
    • 1117-19-7
    • dipropyl propanedioate
    • Propanedioic acid, dipropyl ester
    • 1,3-dipropyl propanedioate
    • Malonic Acid Dipropyl Ester
    • Di-n-propyl malonate
    • DTXSID90333753
    • Dipropylmalonate
    • malonic acid di-n-propyl ester
    • Dipropyl malonate #
    • MFCD00059406
    • Dipropyl malonate, AldrichCPR
    • SCHEMBL240282
    • DTXCID00284843
    • LWIWFCDNJNZEKB-UHFFFAOYSA-N
    • AKOS005207016
    • AS-56870
    • DB-041002
    • CS-0152061
    • M0034
    • H11316
    • Q63409552
    • 678-589-4

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 167.12
    methanol 226.52
    isopropanol 126.23
    water 0.59
    ethyl acetate 263.54
    n-propanol 117.24
    acetone 701.35
    n-butanol 112.89
    acetonitrile 327.54
    DMF 1630.64
    toluene 157.84
    isobutanol 99.6
    1,4-dioxane 345.91
    methyl acetate 332.83
    THF 882.28
    2-butanone 366.18
    n-pentanol 78.67
    sec-butanol 107.06
    n-hexane 22.5
    ethylene glycol 73.34
    NMP 1873.99
    cyclohexane 34.97
    DMSO 1873.29
    n-butyl acetate 189.84
    n-octanol 45.97
    chloroform 1134.51
    n-propyl acetate 152.19
    acetic acid 581.37
    dichloromethane 1150.99
    cyclohexanone 654.4
    propylene glycol 100.19
    isopropyl acetate 175.73
    DMAc 1572.34
    2-ethoxyethanol 169.76
    isopentanol 116.51
    n-heptane 8.78
    ethyl formate 218.71
    1,2-dichloroethane 779.22
    n-hexanol 75.2
    2-methoxyethanol 346.35
    isobutyl acetate 103.19
    tetrachloromethane 122.38
    n-pentyl acetate 112.92
    transcutol 548.68
    n-heptanol 33.36
    ethylbenzene 96.91
    MIBK 177.37
    2-propoxyethanol 192.17
    tert-butanol 196.75
    MTBE 175.47
    2-butoxyethanol 102.13
    propionic acid 284.22
    o-xylene 123.52
    formic acid 215.27
    diethyl ether 125.56
    m-xylene 115.02
    p-xylene 134.36
    chlorobenzene 344.75
    dimethyl carbonate 206.17
    n-octane 4.12
    formamide 309.67
    cyclopentanone 1065.49
    2-pentanone 273.47
    anisole 198.08
    cyclopentyl methyl ether 305.95
    gamma-butyrolactone 1228.03
    1-methoxy-2-propanol 271.78
    pyridine 511.28
    3-pentanone 234.31
    furfural 1000.35
    n-dodecane 4.18
    diethylene glycol 183.33
    diisopropyl ether 47.65
    tert-amyl alcohol 160.98
    acetylacetone 538.1
    n-hexadecane 5.0
    acetophenone 270.65
    methyl propionate 289.01
    isopentyl acetate 189.86
    trichloroethylene 1672.62
    n-nonanol 42.2
    cyclohexanol 170.68
    benzyl alcohol 165.71
    2-ethylhexanol 61.46
    isooctanol 31.92
    dipropyl ether 68.53
    1,2-dichlorobenzene 381.68
    ethyl lactate 110.83
    propylene carbonate 616.43
    n-methylformamide 471.97
    2-pentanol 75.72
    n-pentane 14.57
    1-propoxy-2-propanol 143.57
    1-methoxy-2-propyl acetate 234.85
    2-(2-methoxypropoxy) propanol 182.27
    mesitylene 72.08
    ε-caprolactone 509.31
    p-cymene 56.48
    epichlorohydrin 1019.53
    1,1,1-trichloroethane 648.42
    2-aminoethanol 111.8
    morpholine-4-carbaldehyde 865.91
    sulfolane 1889.28
    2,2,4-trimethylpentane 14.28
    2-methyltetrahydrofuran 496.89
    n-hexyl acetate 171.14
    isooctane 8.88
    2-(2-butoxyethoxy)ethanol 185.37
    sec-butyl acetate 111.61
    tert-butyl acetate 225.61
    decalin 29.72
    glycerin 169.07
    diglyme 365.96
    acrylic acid 349.54
    isopropyl myristate 62.9
    n-butyric acid 318.18
    acetyl acetate 289.07
    di(2-ethylhexyl) phthalate 97.56
    ethyl propionate 164.73
    nitromethane 1069.84
    1,2-diethoxyethane 138.01
    benzonitrile 289.56
    trioctyl phosphate 56.32
    1-bromopropane 268.74
    gamma-valerolactone 1000.2
    n-decanol 30.31
    triethyl phosphate 107.5
    4-methyl-2-pentanol 53.82
    propionitrile 190.01
    vinylene carbonate 524.41
    1,1,2-trichlorotrifluoroethane 874.93
    DMS 242.56
    cumene 66.6
    2-octanol 27.17
    2-hexanone 171.79
    octyl acetate 83.92
    limonene 88.02
    1,2-dimethoxyethane 383.38
    ethyl orthosilicate 90.92
    tributyl phosphate 91.63
    diacetone alcohol 269.28
    N,N-dimethylaniline 174.25
    acrylonitrile 332.12
    aniline 210.21
    1,3-propanediol 150.22
    bromobenzene 391.18
    dibromomethane 705.08
    1,1,2,2-tetrachloroethane 1293.49
    2-methyl-cyclohexyl acetate 149.02
    tetrabutyl urea 135.5
    diisobutyl methanol 43.51
    2-phenylethanol 136.33
    styrene 131.42
    dioctyl adipate 132.65
    dimethyl sulfate 568.66
    ethyl butyrate 146.25
    methyl lactate 201.39
    butyl lactate 123.03
    diethyl carbonate 125.86
    propanediol butyl ether 136.95
    triethyl orthoformate 109.62
    p-tert-butyltoluene 54.57
    methyl 4-tert-butylbenzoate 193.76
    morpholine 438.85
    tert-butylamine 117.06
    n-dodecanol 23.34
    dimethoxymethane 380.61
    ethylene carbonate 387.79
    cyrene 256.23
    2-ethoxyethyl acetate 167.07
    2-ethylhexyl acetate 151.64
    1,2,4-trichlorobenzene 482.49
    4-methylpyridine 531.44
    dibutyl ether 66.49
    2,6-dimethyl-4-heptanol 43.51
    DEF 468.74
    dimethyl isosorbide 358.57
    tetrachloroethylene 669.64
    eugenol 174.82
    triacetin 232.45
    span 80 153.1
    1,4-butanediol 64.38
    1,1-dichloroethane 590.0
    2-methyl-1-pentanol 88.62
    methyl formate 382.09
    2-methyl-1-butanol 109.59
    n-decane 6.72
    butyronitrile 198.05
    3,7-dimethyl-1-octanol 61.55
    1-chlorooctane 41.94
    1-chlorotetradecane 18.13
    n-nonane 6.36
    undecane 5.11
    tert-butylcyclohexane 22.69
    cyclooctane 11.48
    cyclopentanol 227.48
    tetrahydropyran 309.99
    tert-amyl methyl ether 154.35
    2,5,8-trioxanonane 276.14
    1-hexene 70.46
    2-isopropoxyethanol 114.62
    2,2,2-trifluoroethanol 256.53
    methyl butyrate 244.44

    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