Isodecyl acrylate

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  • Identifiers

    CAS number
    1330-61-6

    Molecular formula
    C13H24O2

    SMILES
    CC(C)CCCCCCCOC(=O)C=C

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fruity 47.14%
    Floral 45.26%
    Sweet 45.01%
    Fresh 42.56%
    Waxy 41.98%
    Herbal 40.93%
    Fatty 37.31%
    Oily 37.23%
    Rose 36.88%
    Peach 29.06%

    Scent© AI

  • Properties

    XLogP3-AA
    5.3

    pKa est.
    8.15 (weak base)

    Molecular weight
    212.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Melting point expt.

    • -148 °F (USCG, 1999)
    • -100 °C

    Boiling point

    • 158 °C @ 50 mm Hg
    • Polymerizes at boiling point; vapor pressure <0.01 mm Hg at 20 °C

    Flash point est.
    109.31 ˚C

    Flash point expt.

    • 240 °F (USCG, 1999)
    • 240 °F (open cup)

    Solubility expt.

    • Negligible in water, <0.01% @ 20 °C
    • Solubility in water: 0.010 lb/100 lb at 68 °C

  • Synonyms

    • ISODECYL ACRYLATE
    • 1330-61-6
    • 2-Propenoic acid, isodecyl ester
    • 8-methylnonyl prop-2-enoate
    • 8-methylnonyl acrylate
    • Isodecyl propenoate
    • Isodecyl alcohol, acrylate
    • Ageflex FA-10
    • Acrylic acid, isodecyl ester
    • iso-Decyl acrylate
    • HSDB 615
    • UNII-WET3U98PW2
    • 928714-73-2
    • EINECS 215-542-5
    • WET3U98PW2
    • MIRAMER 130
    • EC 215-542-5
    • ISODECYL PROPENOATE [HSDB]
    • DSSTox_CID_7386
    • DSSTox_RID_78431
    • DSSTox_GSID_27386
    • Isodecyl acrylate(5 cp(25 degrees c))
    • CAS-1330-61-6
    • Ageflex FA10
    • MFCD00080455
    • 8-methylnonylacrylate
    • 8-Methylnonyl propenoate
    • 8-Methylnonyl 2-propenoate
    • SCHEMBL35574
    • 2Propenoic acid, isodecyl ester
    • CHEMBL3186945
    • DTXSID7027386
    • ISODECYL ACRYLATE [INCI]
    • DTXSID10859622
    • Tox21_201861
    • Tox21_303085
    • AKOS015838906
    • NCGC00257121-01
    • NCGC00259410-01
    • NS00001073
    • Isodecyl acrylate, contains MEHQ as inhibitor
    • G61936
    • Q27292596
    • Isodecyl acrylate, 98%, contains 70-100 ppm hydroquinone as stabilizer
    • 215-542-5

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1440.07
    methanol 1014.35
    isopropanol 1264.2
    water 0.01
    ethyl acetate 2497.99
    n-propanol 1206.68
    acetone 2131.06
    n-butanol 1195.87
    acetonitrile 875.68
    DMF 1113.37
    toluene 719.42
    isobutanol 918.41
    1,4-dioxane 1589.95
    methyl acetate 1279.38
    THF 3743.08
    2-butanone 2404.38
    n-pentanol 1079.42
    sec-butanol 1293.09
    n-hexane 472.69
    ethylene glycol 34.02
    NMP 1071.41
    cyclohexane 448.74
    DMSO 1375.52
    n-butyl acetate 2326.32
    n-octanol 409.13
    chloroform 2281.08
    n-propyl acetate 1912.65
    acetic acid 476.38
    dichloromethane 2497.32
    cyclohexanone 2832.26
    propylene glycol 139.69
    isopropyl acetate 1701.11
    DMAc 1149.78
    2-ethoxyethanol 1036.96
    isopentanol 1285.63
    n-heptane 161.23
    ethyl formate 697.28
    1,2-dichloroethane 2088.42
    n-hexanol 1155.24
    2-methoxyethanol 1211.61
    isobutyl acetate 1121.46
    tetrachloromethane 350.95
    n-pentyl acetate 1047.97
    transcutol 3834.36
    n-heptanol 389.17
    ethylbenzene 461.16
    MIBK 1335.08
    2-propoxyethanol 1452.46
    tert-butanol 1564.15
    MTBE 2597.81
    2-butoxyethanol 704.75
    propionic acid 516.98
    o-xylene 452.94
    formic acid 65.57
    diethyl ether 2534.96
    m-xylene 555.4
    p-xylene 569.3
    chlorobenzene 898.44
    dimethyl carbonate 199.39
    n-octane 61.28
    formamide 126.8
    cyclopentanone 2247.47
    2-pentanone 2425.34
    anisole 812.14
    cyclopentyl methyl ether 2164.77
    gamma-butyrolactone 1809.01
    1-methoxy-2-propanol 1230.71
    pyridine 1449.25
    3-pentanone 1300.24
    furfural 1181.32
    n-dodecane 34.51
    diethylene glycol 483.05
    diisopropyl ether 781.12
    tert-amyl alcohol 1498.06
    acetylacetone 1532.6
    n-hexadecane 42.25
    acetophenone 748.62
    methyl propionate 1175.61
    isopentyl acetate 1995.52
    trichloroethylene 2972.34
    n-nonanol 351.45
    cyclohexanol 1159.06
    benzyl alcohol 536.84
    2-ethylhexanol 818.78
    isooctanol 384.64
    dipropyl ether 1295.4
    1,2-dichlorobenzene 817.44
    ethyl lactate 361.36
    propylene carbonate 1006.6
    n-methylformamide 424.55
    2-pentanol 1142.39
    n-pentane 228.07
    1-propoxy-2-propanol 1359.73
    1-methoxy-2-propyl acetate 1540.41
    2-(2-methoxypropoxy) propanol 699.62
    mesitylene 369.85
    ε-caprolactone 2017.3
    p-cymene 294.38
    epichlorohydrin 2690.11
    1,1,1-trichloroethane 1877.83
    2-aminoethanol 197.41
    morpholine-4-carbaldehyde 1133.42
    sulfolane 1778.58
    2,2,4-trimethylpentane 125.43
    2-methyltetrahydrofuran 3372.26
    n-hexyl acetate 1234.06
    isooctane 111.48
    2-(2-butoxyethoxy)ethanol 978.55
    sec-butyl acetate 1382.66
    tert-butyl acetate 1670.38
    decalin 202.54
    glycerin 126.9
    diglyme 1757.15
    acrylic acid 253.12
    isopropyl myristate 398.41
    n-butyric acid 1393.03
    acetyl acetate 815.46
    di(2-ethylhexyl) phthalate 291.49
    ethyl propionate 1393.58
    nitromethane 921.38
    1,2-diethoxyethane 2113.4
    benzonitrile 743.63
    trioctyl phosphate 214.92
    1-bromopropane 1812.97
    gamma-valerolactone 2276.97
    n-decanol 244.6
    triethyl phosphate 364.35
    4-methyl-2-pentanol 666.65
    propionitrile 909.78
    vinylene carbonate 695.95
    1,1,2-trichlorotrifluoroethane 1010.11
    DMS 598.61
    cumene 312.31
    2-octanol 329.15
    2-hexanone 1928.84
    octyl acetate 466.76
    limonene 560.2
    1,2-dimethoxyethane 2120.39
    ethyl orthosilicate 386.02
    tributyl phosphate 315.92
    diacetone alcohol 1240.15
    N,N-dimethylaniline 498.79
    acrylonitrile 706.16
    aniline 616.8
    1,3-propanediol 422.02
    bromobenzene 1073.07
    dibromomethane 1932.38
    1,1,2,2-tetrachloroethane 2435.05
    2-methyl-cyclohexyl acetate 868.66
    tetrabutyl urea 382.35
    diisobutyl methanol 452.47
    2-phenylethanol 615.17
    styrene 588.92
    dioctyl adipate 532.84
    dimethyl sulfate 312.15
    ethyl butyrate 1363.71
    methyl lactate 290.21
    butyl lactate 582.9
    diethyl carbonate 624.49
    propanediol butyl ether 538.81
    triethyl orthoformate 732.16
    p-tert-butyltoluene 289.26
    methyl 4-tert-butylbenzoate 546.41
    morpholine 2452.37
    tert-butylamine 1007.02
    n-dodecanol 176.75
    dimethoxymethane 1031.79
    ethylene carbonate 652.79
    cyrene 498.02
    2-ethoxyethyl acetate 1125.37
    2-ethylhexyl acetate 1506.02
    1,2,4-trichlorobenzene 887.15
    4-methylpyridine 1691.54
    dibutyl ether 1086.74
    2,6-dimethyl-4-heptanol 452.47
    DEF 1725.44
    dimethyl isosorbide 1170.93
    tetrachloroethylene 1353.69
    eugenol 504.85
    triacetin 741.17
    span 80 630.86
    1,4-butanediol 180.89
    1,1-dichloroethane 2297.9
    2-methyl-1-pentanol 1068.79
    methyl formate 265.39
    2-methyl-1-butanol 1077.24
    n-decane 75.6
    butyronitrile 1403.02
    3,7-dimethyl-1-octanol 556.62
    1-chlorooctane 394.2
    1-chlorotetradecane 119.92
    n-nonane 78.84
    undecane 48.29
    tert-butylcyclohexane 199.68
    cyclooctane 128.53
    cyclopentanol 966.19
    tetrahydropyran 3289.39
    tert-amyl methyl ether 1668.57
    2,5,8-trioxanonane 1022.32
    1-hexene 1617.65
    2-isopropoxyethanol 936.46
    2,2,2-trifluoroethanol 88.6
    methyl butyrate 1881.43

    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