Helicide

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  • Identifiers

    CAS number
    80154-34-3

    Molecular formula
    C13H16O7

    SMILES
    C1=CC(=CC=C1C=O)O[C@H]2[C@@H]([C@@H]([C@@H]([C@H](O2)CO)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 55.96%
    Sweet 46.44%
    Vanilla 41.89%
    Bitter 25.48%
    Caramellic 25.08%
    Spicy 24.05%
    Milky 22.44%
    Phenolic 22.2%
    Creamy 21.86%
    Almond 20.25%

     

    Flavor
    Bitter 76.95%
    Sweet 46.35%
    Odorless 28.93%
    Vanilla 28.06%
    Sweet-like 25.18%
    Naphthalic 21.28%
    Very slight 20.53%
    Fenugreek 20.44%
    Bland 20.39%
    Cadaverous 20.24%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -0.9

    pKa est.
    6.32 (neutral)

    Molecular weight
    284.26 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1323°C

    Flash point

    • 242.46 ˚C est.

  • Synonyms

    • 80154-34-3
    • Helicide
    • 4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
    • 4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxybenzaldehyde
    • RefChem:145476
    • DTXCID301477693
    • DTXSID701019801
    • Helicid
    • 4-(((2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)benzaldehyde
    • Benzaldehyde, 4-(b-D-allopyranosyloxy)-
    • 4-Formylphenyl beta-D-Allopyranoside
    • MFCD00210992
    • 4-(BETA-D-ALLOPYRANOSYLOXY)-BENZALDEHYDE
    • 4-FORMYLPHENYL B-D-ALLOPYRANOSIDE
    • CHEMBL201358
    • 4-[[(2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy]benzaldehyde
    • Helicid (Standard)
    • 4-(beta-D-Allopyranosyloxy)benzaldehyde
    • 4-{[(2S,3R,4R,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}BENZALDEHYDE
    • orb1304211
    • SCHEMBL17822698
    • HY-N0343R
    • CHEBI:189486
    • HMS3885A06
    • 4-b-D-Allopyranosyloxy)benzaldehyde
    • HY-N0343
    • BDBM50177404
    • s3797
    • AKOS025310966
    • CCG-267289
    • EBC-617679
    • MF07020
    • AS-30535
    • DA-74079
    • SY077439
    • CS-0008901
    • F0542
    • 154H343
    • F386372
    • Helicide; Helicidum;4-Formylphenyl--D-allopyranoside
    • 4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)benzaldehyde
    • 4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)benzaldehyde
    • 4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxybenzaldehyde
    • 80154-34-3

  • Applications

    Helicide (CAS 80154-34-3) is used primarily as a biocidal/antimicrobial agent in industrial cleaning and process water systems, serving to control microbial growth in challenging manufacturing environments. It is also evaluated as a preservative or antimicrobial component in cosmetics and personal care formulations. As an additive in coatings and inks, it provides biocidal protection and surface stabilization. In polymers and plastics, it may act as a stabilizer or processing aid. It is sometimes considered for agricultural sanitation and equipment disinfection in farming and processing operations, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 7.31
    methanol 37.71
    isopropanol 3.86
    water 35.46
    ethyl acetate 1.43
    n-propanol 3.77
    acetone 4.97
    n-butanol 9.64
    acetonitrile 2.23
    DMF 86.78
    toluene 1.31
    isobutanol 1.39
    1,4-dioxane 10.74
    methyl acetate 1.13
    THF 16.41
    2-butanone 1.86
    n-pentanol 1.45
    sec-butanol 2.58
    n-hexane 0.08
    ethylene glycol 84.27
    NMP 35.96
    cyclohexane 0.65
    DMSO 395.51
    n-butyl acetate 0.45
    n-octanol 1.63
    chloroform 0.15
    n-propyl acetate 0.53
    acetic acid 42.96
    dichloromethane 0.18
    cyclohexanone 5.24
    propylene glycol 33.07
    isopropyl acetate 0.99
    DMAc 80.91
    2-ethoxyethanol 32.98
    isopentanol 3.74
    n-heptane 0.39
    ethyl formate 2.22
    1,2-dichloroethane 0.47
    n-hexanol 1.66
    2-methoxyethanol 121.13
    isobutyl acetate 0.24
    tetrachloromethane 0.11
    n-pentyl acetate 0.79
    transcutol 52.5
    n-heptanol 2.16
    ethylbenzene 0.45
    MIBK 1.8
    2-propoxyethanol 13.37
    tert-butanol 4.53
    MTBE 0.89
    2-butoxyethanol 8.67
    propionic acid 5.4
    o-xylene 1.33
    formic acid 229.41
    diethyl ether 1.57
    m-xylene 1.04
    p-xylene 0.4
    chlorobenzene 0.26
    dimethyl carbonate 5.3
    n-octane 0.23
    formamide 245.77
    cyclopentanone 7.98
    2-pentanone 3.09
    anisole 1.43
    cyclopentyl methyl ether 5.04
    gamma-butyrolactone 10.26
    1-methoxy-2-propanol 53.27
    pyridine 4.78
    3-pentanone 1.81
    furfural 14.61
    n-dodecane 0.14
    diethylene glycol 45.48
    diisopropyl ether 0.47
    tert-amyl alcohol 3.33
    acetylacetone 7.03
    n-hexadecane 0.15
    acetophenone 2.39
    methyl propionate 2.67
    isopentyl acetate 0.52
    trichloroethylene 0.69
    n-nonanol 1.8
    cyclohexanol 7.34
    benzyl alcohol 3.7
    2-ethylhexanol 0.97
    isooctanol 1.55
    dipropyl ether 1.66
    1,2-dichlorobenzene 0.3
    ethyl lactate 4.15
    propylene carbonate 3.51
    n-methylformamide 37.41
    2-pentanol 2.93
    n-pentane 0.17
    1-propoxy-2-propanol 7.64
    1-methoxy-2-propyl acetate 3.04
    2-(2-methoxypropoxy) propanol 11.55
    mesitylene 0.68
    ε-caprolactone 4.83
    p-cymene 0.54
    epichlorohydrin 5.83
    1,1,1-trichloroethane 0.14
    2-aminoethanol 52.32
    morpholine-4-carbaldehyde 48.97
    sulfolane 39.24
    2,2,4-trimethylpentane 0.08
    2-methyltetrahydrofuran 3.88
    n-hexyl acetate 1.25
    isooctane 0.05
    2-(2-butoxyethoxy)ethanol 16.81
    sec-butyl acetate 0.39
    tert-butyl acetate 1.7
    decalin 0.13
    glycerin 121.82
    diglyme 28.7
    acrylic acid 12.17
    isopropyl myristate 0.78
    n-butyric acid 6.93
    acetyl acetate 1.7
    di(2-ethylhexyl) phthalate 1.49
    ethyl propionate 0.78
    nitromethane 38.43
    1,2-diethoxyethane 3.28
    benzonitrile 1.16
    trioctyl phosphate 1.2
    1-bromopropane 0.23
    gamma-valerolactone 22.48
    n-decanol 1.48
    triethyl phosphate 1.31
    4-methyl-2-pentanol 1.32
    propionitrile 1.09
    vinylene carbonate 3.36
    1,1,2-trichlorotrifluoroethane 22.74
    DMS 1.82
    cumene 0.32
    2-octanol 1.12
    2-hexanone 0.71
    octyl acetate 1.15
    limonene 0.83
    1,2-dimethoxyethane 19.02
    ethyl orthosilicate 1.24
    tributyl phosphate 1.1
    diacetone alcohol 9.86
    N,N-dimethylaniline 1.93
    acrylonitrile 2.61
    aniline 3.59
    1,3-propanediol 71.93
    bromobenzene 0.17
    dibromomethane 0.13
    1,1,2,2-tetrachloroethane 0.89
    2-methyl-cyclohexyl acetate 1.12
    tetrabutyl urea 2.65
    diisobutyl methanol 0.99
    2-phenylethanol 2.51
    styrene 0.41
    dioctyl adipate 1.81
    dimethyl sulfate 14.06
    ethyl butyrate 0.88
    methyl lactate 17.63
    butyl lactate 2.64
    diethyl carbonate 0.82
    propanediol butyl ether 11.49
    triethyl orthoformate 1.44
    p-tert-butyltoluene 0.56
    methyl 4-tert-butylbenzoate 5.03
    morpholine 18.87
    tert-butylamine 1.25
    n-dodecanol 1.2
    dimethoxymethane 26.04
    ethylene carbonate 2.5
    cyrene 16.55
    2-ethoxyethyl acetate 1.92
    2-ethylhexyl acetate 0.37
    1,2,4-trichlorobenzene 0.51
    4-methylpyridine 2.61
    dibutyl ether 1.1
    2,6-dimethyl-4-heptanol 0.99
    DEF 11.33
    dimethyl isosorbide 15.44
    tetrachloroethylene 0.94
    eugenol 6.33
    triacetin 3.86
    span 80 8.45
    1,4-butanediol 15.04
    1,1-dichloroethane 0.12
    2-methyl-1-pentanol 1.18
    methyl formate 19.28
    2-methyl-1-butanol 2.75
    n-decane 0.25
    butyronitrile 1.46
    3,7-dimethyl-1-octanol 1.31
    1-chlorooctane 0.45
    1-chlorotetradecane 0.24
    n-nonane 0.23
    undecane 0.18
    tert-butylcyclohexane 0.06
    cyclooctane 0.36
    cyclopentanol 5.29
    tetrahydropyran 4.55
    tert-amyl methyl ether 1.36
    2,5,8-trioxanonane 25.9
    1-hexene 0.17
    2-isopropoxyethanol 9.33
    2,2,2-trifluoroethanol 21.17
    methyl butyrate 1.15

    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