1,4:3,6-Dianhydro-D-glucitol monolaurate

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  • Identifiers

    CAS number
    28454-97-9

    Molecular formula
    C18H32O5

    SMILES
    CCCCCCCCCCCC(=O)O[C@H]1CO[C@H]2[C@@H]1OC[C@H]2O

    Safety labels

  • Odor profile

    Fragrance
    Fatty 46.41%
    Waxy 45.84%
    Oily 41.65%
    Odorless 37.98%
    Lactonic 30.79%
    Peach 29.05%
    Milky 26.72%
    Buttery 26.52%
    Creamy 24.39%
    Citrus 24.03%

     

    Flavor
    Fatty 46.72%
    Waxy 41.15%
    Oily 36.6%
    Bland 32.27%
    Mild 30.28%
    Odorless 25.94%
    Creamy 25.47%
    Coconut 25.26%
    Slightly waxy 22.94%
    Bay oil 22.37%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.4

    pKa est.
    7.39 (neutral)

    Molecular weight
    328.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    472°C

    Flash point

    • 200.04 ˚C est.

  • Synonyms

    • isosorbide laurate
    • 1,4:3,6-Dianhydro-D-glucitol monolaurate
    • Isosorbide 2-laurate
    • Isosorbide-2-laurate
    • 28454-97-9
    • UNII-85608C91Q3
    • Isosorbide 2-dodecanoate
    • EINECS 249-032-9
    • LJV674T42F
    • 85608C91Q3
    • D-Glucitol, 1,4:3,6-dianhydro-, 2-dodecanoate
    • 54353-33-2
    • UNII-LJV674T42F
    • SCHEMBL437078
    • DTXSID80182651
    • CEZONBVMFRWNCJ-CYGHRXIMSA-N
    • 1,4:3,6-Dianhydro-2-O-dodecanoyl-D-glucitol
    • Q27283038
    • 28454-97-9

  • Applications

    1,4:3,6-Dianhydro-D-glucitol monolaurate (CAS 28454-97-9) is primarily used as a nonionic surfactant and emulsifier in cosmetic and personal-care formulations, and as an emollient and stabilizer for emulsions in household and industrial cleaners. It can also serve as a precursor or intermediate for the synthesis of other sugar esters or sugar-based surfactant derivatives, and may function as an emulsifying aid or compatibility additive in polymer systems and coatings/inks. In agricultural formulations, it may be evaluated as an emulsifier or adjuvant for agrochemical products. Its use is typically formulation- and regulation-dependent.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 501.18
    methanol 894.0
    isopropanol 330.93
    water 6.83
    ethyl acetate 1136.44
    n-propanol 389.84
    acetone 1085.64
    n-butanol 372.72
    acetonitrile 828.08
    DMF 941.11
    toluene 180.24
    isobutanol 295.04
    1,4-dioxane 756.26
    methyl acetate 768.79
    THF 1524.25
    2-butanone 718.41
    n-pentanol 252.43
    sec-butanol 290.68
    n-hexane 7.88
    ethylene glycol 103.53
    NMP 860.98
    cyclohexane 41.65
    DMSO 1584.4
    n-butyl acetate 591.85
    n-octanol 145.89
    chloroform 2119.08
    n-propyl acetate 765.36
    acetic acid 1428.26
    dichloromethane 2464.0
    cyclohexanone 1282.63
    propylene glycol 112.64
    isopropyl acetate 847.24
    DMAc 1015.71
    2-ethoxyethanol 735.13
    isopentanol 379.34
    n-heptane 9.44
    ethyl formate 808.32
    1,2-dichloroethane 1360.23
    n-hexanol 187.66
    2-methoxyethanol 924.81
    isobutyl acetate 448.01
    tetrachloromethane 263.37
    n-pentyl acetate 558.71
    transcutol 1802.71
    n-heptanol 150.97
    ethylbenzene 98.72
    MIBK 488.12
    2-propoxyethanol 522.83
    tert-butanol 362.75
    MTBE 340.95
    2-butoxyethanol 490.01
    propionic acid 630.34
    o-xylene 137.81
    formic acid 711.88
    diethyl ether 321.16
    m-xylene 129.62
    p-xylene 149.98
    chlorobenzene 436.13
    dimethyl carbonate 388.42
    n-octane 7.97
    formamide 1074.29
    cyclopentanone 1364.08
    2-pentanone 741.33
    anisole 288.92
    cyclopentyl methyl ether 512.27
    gamma-butyrolactone 1846.44
    1-methoxy-2-propanol 645.28
    pyridine 832.7
    3-pentanone 460.08
    furfural 1364.4
    n-dodecane 8.33
    diethylene glycol 390.84
    diisopropyl ether 113.72
    tert-amyl alcohol 302.94
    acetylacetone 1141.01
    n-hexadecane 9.92
    acetophenone 442.51
    methyl propionate 667.68
    isopentyl acetate 523.91
    trichloroethylene 2455.11
    n-nonanol 132.19
    cyclohexanol 421.26
    benzyl alcohol 307.77
    2-ethylhexanol 131.0
    isooctanol 136.91
    dipropyl ether 147.44
    1,2-dichlorobenzene 462.1
    ethyl lactate 326.29
    propylene carbonate 1133.4
    n-methylformamide 751.81
    2-pentanol 244.07
    n-pentane 9.39
    1-propoxy-2-propanol 364.45
    1-methoxy-2-propyl acetate 565.93
    2-(2-methoxypropoxy) propanol 325.29
    mesitylene 85.85
    ε-caprolactone 1342.06
    p-cymene 73.9
    epichlorohydrin 1881.66
    1,1,1-trichloroethane 1012.72
    2-aminoethanol 240.67
    morpholine-4-carbaldehyde 942.17
    sulfolane 1542.46
    2,2,4-trimethylpentane 12.99
    2-methyltetrahydrofuran 865.2
    n-hexyl acetate 522.25
    isooctane 8.18
    2-(2-butoxyethoxy)ethanol 480.93
    sec-butyl acetate 500.98
    tert-butyl acetate 639.81
    decalin 22.08
    glycerin 226.06
    diglyme 1193.5
    acrylic acid 557.4
    isopropyl myristate 140.29
    n-butyric acid 1323.43
    acetyl acetate 988.53
    di(2-ethylhexyl) phthalate 143.21
    ethyl propionate 570.06
    nitromethane 2455.12
    1,2-diethoxyethane 547.14
    benzonitrile 503.69
    trioctyl phosphate 112.21
    1-bromopropane 431.89
    gamma-valerolactone 1826.23
    n-decanol 82.04
    triethyl phosphate 196.87
    4-methyl-2-pentanol 162.17
    propionitrile 458.74
    vinylene carbonate 1024.49
    1,1,2-trichlorotrifluoroethane 1223.07
    DMS 426.39
    cumene 74.19
    2-octanol 112.1
    2-hexanone 459.74
    octyl acetate 192.46
    limonene 108.79
    1,2-dimethoxyethane 952.18
    ethyl orthosilicate 182.13
    tributyl phosphate 159.1
    diacetone alcohol 573.38
    N,N-dimethylaniline 174.43
    acrylonitrile 624.27
    aniline 300.3
    1,3-propanediol 452.75
    bromobenzene 449.36
    dibromomethane 1164.58
    1,1,2,2-tetrachloroethane 1714.09
    2-methyl-cyclohexyl acetate 291.61
    tetrabutyl urea 187.24
    diisobutyl methanol 80.58
    2-phenylethanol 241.55
    styrene 132.38
    dioctyl adipate 235.21
    dimethyl sulfate 614.7
    ethyl butyrate 430.63
    methyl lactate 363.96
    butyl lactate 388.84
    diethyl carbonate 297.12
    propanediol butyl ether 340.76
    triethyl orthoformate 283.41
    p-tert-butyltoluene 63.76
    methyl 4-tert-butylbenzoate 358.36
    morpholine 1001.6
    tert-butylamine 163.66
    n-dodecanol 57.18
    dimethoxymethane 683.67
    ethylene carbonate 1020.15
    cyrene 337.9
    2-ethoxyethyl acetate 768.74
    2-ethylhexyl acetate 374.11
    1,2,4-trichlorobenzene 536.44
    4-methylpyridine 658.74
    dibutyl ether 190.87
    2,6-dimethyl-4-heptanol 80.58
    DEF 815.4
    dimethyl isosorbide 561.21
    tetrachloroethylene 1196.88
    eugenol 342.66
    triacetin 593.91
    span 80 249.54
    1,4-butanediol 199.12
    1,1-dichloroethane 1026.35
    2-methyl-1-pentanol 252.74
    methyl formate 600.51
    2-methyl-1-butanol 317.76
    n-decane 15.72
    butyronitrile 526.75
    3,7-dimethyl-1-octanol 147.63
    1-chlorooctane 104.18
    1-chlorotetradecane 32.57
    n-nonane 13.1
    undecane 10.7
    tert-butylcyclohexane 14.72
    cyclooctane 12.64
    cyclopentanol 462.31
    tetrahydropyran 762.02
    tert-amyl methyl ether 260.78
    2,5,8-trioxanonane 625.52
    1-hexene 49.87
    2-isopropoxyethanol 478.23
    2,2,2-trifluoroethanol 799.72
    methyl butyrate 902.66

    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